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

Systemtic Name: ethyl 2-[[1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate CAS Name: 2-[[[1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoate Traditional Name: 2-[[1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]benzoic acid ethyl ester Formula: C25H23FN2O3 MolecularWeight: 418.460123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCC3=CC=CC=C3C2C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)N2CCC3=CC=CC=C3C2C4=CC=C(C=C4)F

InChI

InChI=1S/C25H23FN2O3/c1-2-31-24(29)21-9-5-6-10-22(21)27-25(30)28-16-15-17-7-3-4-8-20(17)23(28)18-11-13-19(26)14-12-18/h3-14,23H,2,15-16H2,1H3,(H,27,30)