(1-oxidanylidene-1-phenyl-propan-2-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N2O5S/c1-20(25(29)21-9-4-2-5-10-21)33-26(30)22-11-8-14-24(19-22)34(31,32)28-17-15-27(16-18-28)23-12-6-3-7-13-23/h2-14,19-20H,15-18H2,1H3