methyl 2-[[6,7-diethoxy-1-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[6,7-diethoxy-1-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[6,7-diethoxy-1-(2-methoxy-2-oxo-ethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate CAS Name: 2-[[[6,7-diethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[6,7-diethoxy-1-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate Traditional Name: 2-[[6,7-diethoxy-1-(2-keto-2-methoxy-ethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoic acid methyl ester Formula: C25H30N2O7 MolecularWeight: 470.5149

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)OC)CC(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC=C3C(=O)OC)CC(=O)OC)OCC

InChI

InChI=1S/C25H30N2O7/c1-5-33-21-13-16-11-12-27(20(15-23(28)31-3)18(16)14-22(21)34-6-2)25(30)26-19-10-8-7-9-17(19)24(29)32-4/h7-10,13-14,20H,5-6,11-12,15H2,1-4H3,(H,26,30)