(2-methoxy-2-oxidanylidene-ethyl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: (2-methoxy-2-oxo-ethyl) 6-benzyloxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[[2-[di(propan-2-yl)amino]ethylamino]-oxomethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-benzoxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-keto-2-methoxy-ethyl) ester Formula: C29H39N3O6 MolecularWeight: 525.63646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OCC(=O)OC)C=C(C=C2)OCC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OCC(=O)OC)C=C(C=C2)OCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C29H39N3O6/c1-20(2)31(21(3)4)16-14-30-28(34)27-25-12-11-24(37-18-22-9-7-6-8-10-22)17-23(25)13-15-32(27)29(35)38-19-26(33)36-5/h6-12,17,20-21,27H,13-16,18-19H2,1-5H3,(H,30,34)