N-[(E)-[3-nitro-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]methylideneamino]-2-phenylazanyl-ethanamide

Systemtic Name: N-[(E)-[3-nitro-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]methylideneamino]-2-phenylazanyl-ethanamide Openeye Name: 2-anilino-N-[(E)-[4-(4-benzylpiperazin-1-yl)-3-nitro-phenyl]methyleneamino]acetamide CAS Name: 2-anilino-N-[(E)-[3-nitro-4-[4-(phenylmethyl)-1-piperazinyl]phenyl]methylideneamino]acetamide IUPAC Name: 2-anilino-N-[(E)-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]methylideneamino]acetamide Traditional Name: 2-anilino-N-[(E)-[4-(4-benzylpiperazino)-3-nitro-benzylidene]amino]acetamide Formula: C26H28N6O3 MolecularWeight: 472.53892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)C=NNC(=O)CNC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)/C=N/NC(=O)CNC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H28N6O3/c33-26(19-27-23-9-5-2-6-10-23)29-28-18-22-11-12-24(25(17-22)32(34)35)31-15-13-30(14-16-31)20-21-7-3-1-4-8-21/h1-12,17-18,27H,13-16,19-20H2,(H,29,33)/b28-18+