ethyl 2-[4-(3-methoxyphenyl)sulfonyl-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(3-methoxyphenyl)sulfonyl-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(benzylcarbamoyl)-4-(3-methoxyphenyl)sulfonyl-piperazin-1-yl]acetate CAS Name: 2-[4-(3-methoxyphenyl)sulfonyl-3-[oxo-[(phenylmethyl)amino]methyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(benzylcarbamoyl)-4-(3-methoxyphenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[3-(benzylcarbamoyl)-4-(3-methoxyphenyl)sulfonyl-piperazino]acetic acid ethyl ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)OC

Isomeric SMILES

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)OC

InChI

InChI=1S/C23H29N3O6S/c1-3-32-22(27)17-25-12-13-26(33(29,30)20-11-7-10-19(14-20)31-2)21(16-25)23(28)24-15-18-8-5-4-6-9-18/h4-11,14,21H,3,12-13,15-17H2,1-2H3,(H,24,28)