(4-phenylphenyl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (4-phenylphenyl)methyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (4-phenylphenyl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid (4-phenylbenzyl) ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

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