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

Systemtic Name: (2-methyl-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: (1,1-dimethyl-2-oxo-2-pyrrolidin-1-yl-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 [2-methyl-1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (2-methyl-1-oxo-1-pyrrolidin-1-ylpropan-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-keto-1,1-dimethyl-2-pyrrolidino-ethyl) ester Formula: C33H46N4O5 MolecularWeight: 578.74214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC(C)(C)C(=O)N3CCCC3)C=C(C=C2)OC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC(C)(C)C(=O)N3CCCC3)C=C(C=C2)OC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C33H46N4O5/c1-23(2)36(24(3)4)21-17-34-30(38)29-28-15-14-27(41-26-12-8-7-9-13-26)22-25(28)16-20-37(29)32(40)42-33(5,6)31(39)35-18-10-11-19-35/h7-9,12-15,22-24,29H,10-11,16-21H2,1-6H3,(H,34,38)