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(2Z)-2-cyano-3-(4-methoxy-3-nitrophenyl)-N-(4-methylphenyl)prop-2-enamide

(2Z)-2-cyano-3-(4-methoxy-3-nitrophenyl)-N-(4-methylphenyl)prop-2-enamide

Formula: C18H15N3O4

SMILES: COC1=CC=C(C=C(C#N)C(=O)NC2=CC=C(C)C=C2)C=C1[N+]([O-])=O

IUPAC: (2Z)-2-cyano-3-(4-methoxy-3-nitrophenyl)-N-(4-methylphenyl)prop-2-enamide

InChI: InChI=1S/C18H15N3O4/c1-12-3-6-15(7-4-12)20-18(22)14(11-19)9-13-5-8-17(25-2)16(10-13)21(23)24/h3-10H,1-2H3,(H,20,22)/b14-9-

Composition: C (64.09%), H (4.48%), N (12.46%), O (18.97%)

Molar Mass: 337.335

Atom Count: 40

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 337.106255975
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey DRSBDCSBOVBYDZ-ZROIWOOFSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.22
Topological Polar Surface Area 105.26
Polarizability 34.25
Ring Count 2
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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