N-(2-cyanoethyl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-N-[(1S)-indan-1-yl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-(2-cyanoethyl)-N-[(1S)-indan-1-yl]-3,4-dimethoxy-benzenesulfonamide Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC#N)C2CCC3=CC=CC=C23)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC#N)[C@H]2CCC3=CC=CC=C23)OC

InChI

InChI=1S/C20H22N2O4S/c1-25-19-11-9-16(14-20(19)26-2)27(23,24)22(13-5-12-21)18-10-8-15-6-3-4-7-17(15)18/h3-4,6-7,9,11,14,18H,5,8,10,13H2,1-2H3/t18-/m0/s1