N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]naphthalene-2-sulfonamide Openeye Name: N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxo-pyrrolidin-3-yl]naphthalene-2-sulfonamide CAS Name: N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]-2-naphthalenesulfonamide IUPAC Name: N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]naphthalene-2-sulfonamide Traditional Name: N-[(3R)-1-(3,4-dimethoxyphenyl)-5-keto-pyrrolidin-3-yl]naphthalene-2-sulfonamide Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CC(CC2=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C[C@@H](CC2=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C22H22N2O5S/c1-28-20-10-8-18(13-21(20)29-2)24-14-17(12-22(24)25)23-30(26,27)19-9-7-15-5-3-4-6-16(15)11-19/h3-11,13,17,23H,12,14H2,1-2H3/t17-/m1/s1