4-[(4-aminophenyl)amino]-N,N-bis(2-cyanoethyl)-3-nitro-benzamide

Systemtic Name: 4-[(4-aminophenyl)amino]-N,N-bis(2-cyanoethyl)-3-nitro-benzamide Openeye Name: 4-(4-aminoanilino)-N,N-bis(2-cyanoethyl)-3-nitro-benzamide CAS Name: 4-(4-aminoanilino)-N,N-bis(2-cyanoethyl)-3-nitrobenzamide IUPAC Name: 4-(4-aminoanilino)-N,N-bis(2-cyanoethyl)-3-nitrobenzamide Traditional Name: 4-(4-aminoanilino)-N,N-bis(2-cyanoethyl)-3-nitro-benzamide Formula: C19H18N6O3 MolecularWeight: 378.38462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)NC2=C(C=C(C=C2)C(=O)N(CCC#N)CCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N)NC2=C(C=C(C=C2)C(=O)N(CCC#N)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O3/c20-9-1-11-24(12-2-10-21)19(26)14-3-8-17(18(13-14)25(27)28)23-16-6-4-15(22)5-7-16/h3-8,13,23H,1-2,11-12,22H2