3-[4-(diphenylmethyl)piperazin-1-yl]-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-yl]-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide Openeye Name: 3-(4-benzhydrylpiperazin-1-yl)-N-[(E)-(4-nitrophenyl)methyleneamino]propanamide CAS Name: 3-[4-(diphenylmethyl)-1-piperazinyl]-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide IUPAC Name: 3-(4-benzhydrylpiperazin-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]propanamide Traditional Name: 3-(4-benzhydrylpiperazino)-N-[(E)-(4-nitrobenzylidene)amino]propionamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NN=CC2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCC(=O)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N5O3/c33-26(29-28-21-22-11-13-25(14-12-22)32(34)35)15-16-30-17-19-31(20-18-30)27(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,21,27H,15-20H2,(H,29,33)/b28-21+