(2-oxidanylidene-2-phenylazanyl-ethyl) 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate Openeye Name: (2-anilino-2-oxo-ethyl) 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O5/c23-17(21-15-7-2-1-3-8-15)13-27-19(25)10-11-22-18(24)12-14-6-4-5-9-16(14)20(22)26/h1-9H,10-13H2,(H,21,23)