4-[(4-nitrophenyl)amino]-1-(4-phenylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-[(4-nitrophenyl)amino]-1-(4-phenylpiperazin-1-yl)butan-1-one Openeye Name: 4-(4-nitroanilino)-1-(4-phenylpiperazin-1-yl)butan-1-one CAS Name: 4-(4-nitroanilino)-1-(4-phenyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(4-nitroanilino)-1-(4-phenylpiperazin-1-yl)butan-1-one Traditional Name: 4-(4-nitroanilino)-1-(4-phenylpiperazino)butan-1-one Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c25-20(7-4-12-21-17-8-10-19(11-9-17)24(26)27)23-15-13-22(14-16-23)18-5-2-1-3-6-18/h1-3,5-6,8-11,21H,4,7,12-16H2