butyl 4-[2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]benzoic acid butyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C[C@@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C24H26N2O4/c1-3-4-15-30-24(29)19-9-11-20(12-10-19)25-23(28)16-22-21-8-6-5-7-18(21)13-14-26(22)17(2)27/h5-14,22H,3-4,15-16H2,1-2H3,(H,25,28)/t22-/m1/s1