N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,2-dimethyl-3-oxidanyl-benzenesulfonamide

Systemtic Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-N,2-dimethyl-3-oxidanyl-benzenesulfonamide Openeye Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-3-hydroxy-N,2-dimethyl-benzenesulfonamide CAS Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-3-hydroxy-N,2-dimethylbenzenesulfonamide IUPAC Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-3-hydroxy-N,2-dimethylbenzenesulfonamide Traditional Name: N-[(1R,3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)cyclopentyl]-3-hydroxy-N,2-dimethyl-benzenesulfonamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)N(C)C2CCC(C2)N3CCC4=CC=CC=C4C3)O

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)N(C)[C@@H]2CC[C@@H](C2)N3CCC4=CC=CC=C4C3)O

InChI

InChI=1S/C22H28N2O3S/c1-16-21(25)8-5-9-22(16)28(26,27)23(2)19-10-11-20(14-19)24-13-12-17-6-3-4-7-18(17)15-24/h3-9,19-20,25H,10-15H2,1-2H3/t19-,20+/m1/s1