N-(2-azanyl-3-cyano-4-phenyl-pyrrol-1-yl)-2-nitro-benzamide

Systemtic Name: N-(2-azanyl-3-cyano-4-phenyl-pyrrol-1-yl)-2-nitro-benzamide Openeye Name: N-(2-amino-3-cyano-4-phenyl-pyrrol-1-yl)-2-nitro-benzamide CAS Name: N-(2-amino-3-cyano-4-phenyl-1-pyrrolyl)-2-nitrobenzamide IUPAC Name: N-(2-amino-3-cyano-4-phenylpyrrol-1-yl)-2-nitrobenzamide Traditional Name: N-(2-amino-3-cyano-4-phenyl-pyrrol-1-yl)-2-nitro-benzamide Formula: C18H13N5O3 MolecularWeight: 347.32752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=C2C#N)N)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=C2C#N)N)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3/c19-10-14-15(12-6-2-1-3-7-12)11-22(17(14)20)21-18(24)13-8-4-5-9-16(13)23(25)26/h1-9,11H,20H2,(H,21,24)