2-[[1-ethylsulfonyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[1-ethylsulfonyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[1-ethylsulfonyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[1-ethylsulfonyl-4-(3-methoxyphenyl)-3-pyrrolidinyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[1-ethylsulfonyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[1-esyl-4-(3-methoxyphenyl)pyrrolidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(C(C1)C2=CC(=CC=C2)OC)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CCS(=O)(=O)N1CC(C(C1)C2=CC(=CC=C2)OC)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H30N2O3S/c1-3-29(26,27)25-16-21(23(17-25)19-9-6-10-22(13-19)28-2)15-24-12-11-18-7-4-5-8-20(18)14-24/h4-10,13,21,23H,3,11-12,14-17H2,1-2H3