3,4-dihydro-1H-isoquinolin-2-yl-[4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidin-3-yl]methanone Openeye Name: [1-(benzenesulfonyl)-4-(3-methoxyphenyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(benzenesulfonyl)-4-(3-methoxyphenyl)-3-pyrrolidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(benzenesulfonyl)-4-(3-methoxyphenyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-besyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CN(CC2C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2CN(CC2C(=O)N3CCC4=CC=CC=C4C3)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H28N2O4S/c1-33-23-11-7-10-21(16-23)25-18-29(34(31,32)24-12-3-2-4-13-24)19-26(25)27(30)28-15-14-20-8-5-6-9-22(20)17-28/h2-13,16,25-26H,14-15,17-19H2,1H3