3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: N-(4-benzyloxyphenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: N-(4-benzoxyphenyl)-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4/c28-23(14-15-27-24(29)16-19-8-4-5-9-22(19)25(27)30)26-20-10-12-21(13-11-20)31-17-18-6-2-1-3-7-18/h1-13H,14-17H2,(H,26,28)