N-[(2S)-1-[cyclohexyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[(2S)-1-[cyclohexyl(methyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[(2S)-1-[cyclohexyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[(2S)-1-[cyclohexyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-[cyclohexyl(methyl)amino]-2-keto-ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C28H37N3O4 MolecularWeight: 479.61108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C(CC2=CC=CC=C2)NC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CN(C1CCCCC1)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C28H37N3O4/c1-30(23-12-8-5-9-13-23)27(32)24(16-20-10-6-4-7-11-20)29-28(33)31-15-14-21-17-25(34-2)26(35-3)18-22(21)19-31/h4,6-7,10-11,17-18,23-24H,5,8-9,12-16,19H2,1-3H3,(H,29,33)/t24-/m0/s1