[(2R)-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-propan-2-ylphenyl)amino]propan-2-yl] 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoate Openeye Name: [(1R)-2-(4-isopropylanilino)-1-methyl-2-oxo-ethyl] 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetic acid [(2R)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-propan-2-ylanilino)propan-2-yl] 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]acetic acid [(1R)-2-cumidino-2-keto-1-methyl-ethyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(C)C)OC(=O)C[C@@H]2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C25H28N2O4/c1-16(2)19-9-11-21(12-10-19)26-25(30)17(3)31-24(29)15-23-22-8-6-5-7-20(22)13-14-27(23)18(4)28/h5-14,16-17,23H,15H2,1-4H3,(H,26,30)/t17-,23-/m1/s1