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

Systemtic Name: methyl 4-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]butanoate CAS Name: 4-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]butyric acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NCCCC(=O)OC

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NCCCC(=O)OC

InChI

InChI=1S/C18H22N2O4/c1-13(21)20-11-9-14-6-3-4-7-15(14)16(20)12-17(22)19-10-5-8-18(23)24-2/h3-4,6-7,9,11,16H,5,8,10,12H2,1-2H3,(H,19,22)