ethyl 6,7-dimethoxy-1-(1-oxidanylidene-3-phenyl-propan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 6,7-dimethoxy-1-(1-oxidanylidene-3-phenyl-propan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 1-(1-benzyl-2-oxo-ethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6,7-dimethoxy-1-(1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dimethoxy-1-(1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(1-benzyl-2-keto-ethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1C(CC3=CC=CC=C3)C=O)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC2=CC(=C(C=C2C1C(CC3=CC=CC=C3)C=O)OC)OC

InChI

InChI=1S/C23H27NO5/c1-4-29-23(26)24-11-10-17-13-20(27-2)21(28-3)14-19(17)22(24)18(15-25)12-16-8-6-5-7-9-16/h5-9,13-15,18,22H,4,10-12H2,1-3H3