methyl 3-methyl-2-[[4-(4-phenylmethoxyphenyl)piperazin-1-yl]sulfonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[[4-(4-phenylmethoxyphenyl)piperazin-1-yl]sulfonylamino]butanoate Openeye Name: methyl 2-[[4-(4-benzyloxyphenyl)piperazin-1-yl]sulfonylamino]-3-methyl-butanoate CAS Name: 3-methyl-2-[[4-(4-phenylmethoxyphenyl)-1-piperazinyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[4-(4-phenylmethoxyphenyl)piperazin-1-yl]sulfonylamino]butanoate Traditional Name: 2-[[4-(4-benzoxyphenyl)piperazino]sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O5S/c1-18(2)22(23(27)30-3)24-32(28,29)26-15-13-25(14-16-26)20-9-11-21(12-10-20)31-17-19-7-5-4-6-8-19/h4-12,18,22,24H,13-17H2,1-3H3