ethyl 4-[2-[[1-oxidanylidene-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[[1-oxidanylidene-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(2-benzyl-1-oxo-3,4-dihydroisoquinolin-5-yl)oxy]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[[1-oxo-2-(phenylmethyl)-3,4-dihydroisoquinolin-5-yl]oxy]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-benzyl-1-oxo-3,4-dihydroisoquinolin-5-yl)oxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[(2-benzyl-1-keto-3,4-dihydroisoquinolin-5-yl)oxy]acetyl]amino]benzoic acid ethyl ester Formula: C27H26N2O5 MolecularWeight: 458.50574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC3=C2CCN(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC3=C2CCN(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O5/c1-2-33-27(32)20-11-13-21(14-12-20)28-25(30)18-34-24-10-6-9-23-22(24)15-16-29(26(23)31)17-19-7-4-3-5-8-19/h3-14H,2,15-18H2,1H3,(H,28,30)