N-[2-cyano-4-methoxy-3-[(2-methylquinolin-3-yl)oxymethyl]phenyl]-1,4-bis(oxidanylidene)-2,3-dihydroisoquinoline-3-carboxamide

Systemtic Name: N-[2-cyano-4-methoxy-3-[(2-methylquinolin-3-yl)oxymethyl]phenyl]-1,4-bis(oxidanylidene)-2,3-dihydroisoquinoline-3-carboxamide Openeye Name: N-[2-cyano-4-methoxy-3-[(2-methyl-3-quinolyl)oxymethyl]phenyl]-1,4-dioxo-2,3-dihydroisoquinoline-3-carboxamide CAS Name: N-[2-cyano-4-methoxy-3-[(2-methyl-3-quinolinyl)oxymethyl]phenyl]-1,4-dioxo-2,3-dihydroisoquinoline-3-carboxamide IUPAC Name: N-[2-cyano-4-methoxy-3-[(2-methylquinolin-3-yl)oxymethyl]phenyl]-1,4-dioxo-2,3-dihydroisoquinoline-3-carboxamide Traditional Name: N-[2-cyano-4-methoxy-3-[(2-methyl-3-quinolyl)oxymethyl]phenyl]-1,4-diketo-2,3-dihydroisoquinoline-3-carboxamide Formula: C29H22N4O5 MolecularWeight: 506.50878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C=C1OCC3=C(C=CC(=C3C#N)NC(=O)C4C(=O)C5=CC=CC=C5C(=O)N4)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C=C1OCC3=C(C=CC(=C3C#N)NC(=O)C4C(=O)C5=CC=CC=C5C(=O)N4)OC

InChI

InChI=1S/C29H22N4O5/c1-16-25(13-17-7-3-6-10-22(17)31-16)38-15-21-20(14-30)23(11-12-24(21)37-2)32-29(36)26-27(34)18-8-4-5-9-19(18)28(35)33-26/h3-13,26H,15H2,1-2H3,(H,32,36)(H,33,35)