methyl 2-[2-[(1S)-2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(1S)-2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(1S)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[(1S)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(1S)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[(1S)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC=CC=C2C1CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(=O)N1CCC2=CC=CC=C2[C@@H]1CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H22N2O4/c1-14(24)23-12-11-15-7-3-4-8-16(15)19(23)13-20(25)22-18-10-6-5-9-17(18)21(26)27-2/h3-10,19H,11-13H2,1-2H3,(H,22,25)/t19-/m0/s1