ethyl 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]benzoic acid ethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C22H26N2O5/c1-4-29-22(26)15-5-7-18(8-6-15)23-21(25)14-24-10-9-16-11-19(27-2)20(28-3)12-17(16)13-24/h5-8,11-12H,4,9-10,13-14H2,1-3H3,(H,23,25)