ethyl 2-[1-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]isoquinolin-5-yl]oxypropanoate

Systemtic Name: ethyl 2-[1-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]isoquinolin-5-yl]oxypropanoate Openeye Name: ethyl 2-[[2-[2-(benzylamino)-2-oxo-ethyl]-1-oxo-5-isoquinolyl]oxy]propanoate CAS Name: 2-[[1-oxo-2-[2-oxo-2-[(phenylmethyl)amino]ethyl]-5-isoquinolinyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(benzylamino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxypropanoate Traditional Name: 2-[[2-[2-(benzylamino)-2-keto-ethyl]-1-keto-5-isoquinolyl]oxy]propionic acid ethyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=CC2=C1C=CN(C2=O)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-3-29-23(28)16(2)30-20-11-7-10-19-18(20)12-13-25(22(19)27)15-21(26)24-14-17-8-5-4-6-9-17/h4-13,16H,3,14-15H2,1-2H3,(H,24,26)