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

Systemtic Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-4-[(4-nitrophenyl)amino]butan-1-one Openeye Name: 1-[4-(2-naphthylsulfonyl)piperazin-1-yl]-4-(4-nitroanilino)butan-1-one CAS Name: 1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-4-(4-nitroanilino)-1-butanone IUPAC Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-4-(4-nitroanilino)butan-1-one Traditional Name: 1-[4-(2-naphthylsulfonyl)piperazino]-4-(4-nitroanilino)butan-1-one Formula: C24H26N4O5S MolecularWeight: 482.55204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H26N4O5S/c29-24(6-3-13-25-21-8-10-22(11-9-21)28(30)31)26-14-16-27(17-15-26)34(32,33)23-12-7-19-4-1-2-5-20(19)18-23/h1-2,4-5,7-12,18,25H,3,6,13-17H2