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1-[5-cyano-4-(4-hydroxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

1-[5-cyano-4-(4-hydroxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

Formula: C17H14N3O3

SMILES: OC1=CC=C(C=C1)C1C(C#N)C(=O)NC(=O)C1[N+]1=CC=CC=C1

IUPAC: 1-[5-cyano-4-(4-hydroxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

InChI: InChI=1/C17H13N3O3/c18-10-13-14(11-4-6-12(21)7-5-11)15(17(23)19-16(13)22)20-8-2-1-3-9-20/h1-9,13-15H,(H-,19,21,22,23)/p+1

Composition: C (66.23%), H (4.58%), N (13.63%), O (15.57%)

Molar Mass: 308.316

Atom Count: 37

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 3
Exact Mass 308.102967743
Formal Charge 1
FSP3 0.18
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey IVQIIKPRSLUNNF-UHFFFAOYNA-O
Lipinski's Rule of Five 1
Molar Refractivity 81.99
Topological Polar Surface Area 94.07
Polarizability 31.33
Ring Count 3
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H14N3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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