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

Systemtic Name: [2-methyl-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: [2-(isopropylamino)-1,1-dimethyl-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-methyl-1-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [2-methyl-1-oxo-1-(propan-2-ylamino)propan-2-yl] 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-(isopropylamino)-2-keto-1,1-dimethyl-ethyl] ester Formula: C33H48N4O5 MolecularWeight: 580.75802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)(C)OC(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C(C)(C)OC(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C33H48N4O5/c1-22(2)35-31(39)33(7,8)42-32(40)37-18-16-26-20-27(41-21-25-12-10-9-11-13-25)14-15-28(26)29(37)30(38)34-17-19-36(23(3)4)24(5)6/h9-15,20,22-24,29H,16-19,21H2,1-8H3,(H,34,38)(H,35,39)