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

Systemtic Name: (5-oxidanylideneoxolan-3-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: (5-oxotetrahydrofuran-3-yl) 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 (5-oxo-3-oxolanyl) ester IUPAC Name: (5-oxooxolan-3-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 (5-ketotetrahydrofuran-3-yl) ester Formula: C30H39N3O6 MolecularWeight: 537.64716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC3CC(=O)OC3)C=C(C=C2)OCC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OC3CC(=O)OC3)C=C(C=C2)OCC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C30H39N3O6/c1-20(2)32(21(3)4)15-13-31-29(35)28-26-11-10-24(37-18-22-8-6-5-7-9-22)16-23(26)12-14-33(28)30(36)39-25-17-27(34)38-19-25/h5-11,16,20-21,25,28H,12-15,17-19H2,1-4H3,(H,31,35)