1-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-3,3-diphenyl-propan-1-one Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O5S/c1-20-12-13-23(29(31)32)18-25(20)35(33,34)28-16-14-27(15-17-28)26(30)19-24(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,24H,14-17,19H2,1H3