4-[(2-nitrophenyl)amino]-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-[(2-nitrophenyl)amino]-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(2-nitroanilino)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one CAS Name: 4-(2-nitroanilino)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(2-nitroanilino)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(2-nitroanilino)-1-[4-(4-nitrophenyl)piperazino]butan-1-one Formula: C20H23N5O5 MolecularWeight: 413.42712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O5/c26-20(6-3-11-21-18-4-1-2-5-19(18)25(29)30)23-14-12-22(13-15-23)16-7-9-17(10-8-16)24(27)28/h1-2,4-5,7-10,21H,3,6,11-15H2