(2-naphthalen-1-yl-2-oxidanylidene-ethyl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (2-naphthalen-1-yl-2-oxidanylidene-ethyl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Openeye Name: [2-(1-naphthyl)-2-oxo-ethyl] 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid [2-(1-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-1-yl-2-oxoethyl) 3-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzoic acid [2-keto-2-(1-naphthyl)ethyl] ester Formula: C29H26N2O5S MolecularWeight: 514.59214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H26N2O5S/c32-28(27-15-7-9-22-8-4-5-14-26(22)27)21-36-29(33)23-10-6-13-25(20-23)37(34,35)31-18-16-30(17-19-31)24-11-2-1-3-12-24/h1-15,20H,16-19,21H2