2-[[1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinolin-2-yl]carbonyloxy]-2-methyl-propanoic acid

Systemtic Name: 2-[[1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinolin-2-yl]carbonyloxy]-2-methyl-propanoic acid Openeye Name: 2-[6-benzyloxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carbonyl]oxy-2-methyl-propanoic acid CAS Name: 2-[[1-[[2-[di(propan-2-yl)amino]ethylamino]-oxomethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethoxy]-2-methylpropanoic acid IUPAC Name: 2-[1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl]oxy-2-methylpropanoic acid Traditional Name: 2-[6-benzoxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carbonyl]oxy-2-methyl-propionic acid Formula: C30H41N3O6 MolecularWeight: 539.66304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H41N3O6/c1-20(2)32(21(3)4)17-15-31-27(34)26-25-13-12-24(38-19-22-10-8-7-9-11-22)18-23(25)14-16-33(26)29(37)39-30(5,6)28(35)36/h7-13,18,20-21,26H,14-17,19H2,1-6H3,(H,31,34)(H,35,36)