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

Systemtic Name: (1-azanyl-2-methyl-1-oxidanylidene-propan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: (2-amino-1,1-dimethyl-2-oxo-ethyl) 1-[2-(diisopropylamino)ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[[2-[di(propan-2-yl)amino]ethylamino]-oxomethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (1-amino-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-2-methyl-1-oxopropan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-[2-(diisopropylamino)ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (2-amino-2-keto-1,1-dimethyl-ethyl) ester Formula: C29H40N4O5 MolecularWeight: 524.6517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC(C)(C)C(=O)N)C=C(C=C2)OC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC(C)(C)C(=O)N)C=C(C=C2)OC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C29H40N4O5/c1-19(2)32(20(3)4)17-15-31-26(34)25-24-13-12-23(37-22-10-8-7-9-11-22)18-21(24)14-16-33(25)28(36)38-29(5,6)27(30)35/h7-13,18-20,25H,14-17H2,1-6H3,(H2,30,35)(H,31,34)