methyl 2-[4-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]phenyl]ethanoate Openeye Name: methyl 2-[4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]acetate CAS Name: 2-[4-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]acetate Traditional Name: 2-[4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]acetic acid methyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=C(C=C3)CC(=O)OC

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=C(C=C3)CC(=O)OC

InChI

InChI=1S/C22H22N2O4/c1-15(25)24-12-11-17-5-3-4-6-19(17)20(24)14-21(26)23-18-9-7-16(8-10-18)13-22(27)28-2/h3-12,20H,13-14H2,1-2H3,(H,23,26)