3-[(4-nitrophenyl)amino]-1H-indole-2-carbaldehyde

3-[(4-nitrophenyl)amino]-1H-indole-2-carbaldehyde

CAS: 167954-14-5

Formula: C15H11N3O3

SMILES: [O-][N+](=O)C1=CC=C(NC2=C(NC3=CC=CC=C23)C=O)C=C1

IUPAC: 3-[(4-nitrophenyl)amino]-1H-indole-2-carbaldehyde

InChI: InChI=1S/C15H11N3O3/c19-9-14-15(12-3-1-2-4-13(12)17-14)16-10-5-7-11(8-6-10)18(20)21/h1-9,16-17H

Composition: C (64.05%), H (3.94%), N (14.94%), O (17.06%)

Molar Mass: 281.271

Atom Count: 32

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	281.080041226
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	FFUSCPQVEJMTEU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.41
Topological Polar Surface Area	88.03
Polarizability	30.02
Ring Count	3
Rotatable Bond Count	4

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