N-(3-azanylpropyl)-4-cyano-N-[[2-[(4-nitrophenyl)carbonylamino]phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-cyano-N-[[2-[(4-nitrophenyl)carbonylamino]phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-4-cyano-N-[[2-[(4-nitrobenzoyl)amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-4-cyano-N-[[2-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-4-cyano-N-[[2-[(4-nitrobenzoyl)amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-4-cyano-N-[2-[(4-nitrobenzoyl)amino]benzyl]benzamide Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N5O4/c26-14-3-15-29(25(32)20-8-6-18(16-27)7-9-20)17-21-4-1-2-5-23(21)28-24(31)19-10-12-22(13-11-19)30(33)34/h1-2,4-13H,3,14-15,17,26H2,(H,28,31)