1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(4-nitrophenyl)amino]butan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-[(4-nitrophenyl)amino]butan-1-one Openeye Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-nitroanilino)butan-1-one CAS Name: 1-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-4-(4-nitroanilino)-1-butanone IUPAC Name: 1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-4-(4-nitroanilino)butan-1-one Traditional Name: 1-[4-(3-chlorophenyl)sulfonylpiperazino]-4-(4-nitroanilino)butan-1-one Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN4O5S/c21-16-3-1-4-19(15-16)31(29,30)24-13-11-23(12-14-24)20(26)5-2-10-22-17-6-8-18(9-7-17)25(27)28/h1,3-4,6-9,15,22H,2,5,10-14H2