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

Systemtic Name: ethyl 2-[[1-(2-methoxy-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[1-(2-methoxy-2-oxo-ethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate CAS Name: 2-[[[1-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(2-methoxy-2-oxoethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate Traditional Name: 2-[[1-(2-keto-2-methoxy-ethyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoic acid ethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCC3=CC=CC=C3C2CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCC3=CC=CC=C3C2CC(=O)OC

InChI

InChI=1S/C22H24N2O5/c1-3-29-21(26)17-10-6-7-11-18(17)23-22(27)24-13-12-15-8-4-5-9-16(15)19(24)14-20(25)28-2/h4-11,19H,3,12-14H2,1-2H3,(H,23,27)