[(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbamate

Systemtic Name: [(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbamate Openeye Name: [(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbamate CAS Name: carbamic acid [(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] ester IUPAC Name: [(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbamate Traditional Name: carbamic acid [(3R)-2-(3-phenylpropylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl] ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)CCCC3=CC=CC=C3)OC(=O)N

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)S(=O)(=O)CCCC3=CC=CC=C3)OC(=O)N

InChI

InChI=1S/C19H22N2O4S/c20-19(22)25-18-13-16-10-4-5-11-17(16)14-21(18)26(23,24)12-6-9-15-7-2-1-3-8-15/h1-5,7-8,10-11,18H,6,9,12-14H2,(H2,20,22)/t18-/m1/s1