(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2R)-1-(phenylsulfonyl)pyrrolidin-2-yl]methanone

Systemtic Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[(2R)-1-(phenylsulfonyl)pyrrolidin-2-yl]methanone Openeye Name: [(2R)-1-(benzenesulfonyl)pyrrolidin-2-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [(2R)-1-(benzenesulfonyl)-2-pyrrolidinyl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [(2R)-1-(benzenesulfonyl)pyrrolidin-2-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [(2R)-1-besylpyrrolidin-2-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3CCCN3S(=O)(=O)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)[C@H]3CCCN3S(=O)(=O)C4=CC=CC=C4)OCC

InChI

InChI=1S/C24H30N2O5S/c1-3-30-22-15-18-12-14-25(17-19(18)16-23(22)31-4-2)24(27)21-11-8-13-26(21)32(28,29)20-9-6-5-7-10-20/h5-7,9-10,15-16,21H,3-4,8,11-14,17H2,1-2H3/t21-/m1/s1