(3R)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-methyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-N-(4-benzoxy-3-methoxy-benzyl)-2-mesyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=O)[C@H]3CC4=CC=CC=C4CN3S(=O)(=O)C

InChI

InChI=1S/C27H30N2O5S/c1-28(27(30)24-16-22-11-7-8-12-23(22)18-29(24)35(3,31)32)17-21-13-14-25(26(15-21)33-2)34-19-20-9-5-4-6-10-20/h4-15,24H,16-19H2,1-3H3/t24-/m1/s1