N-[[2-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-oxidanylidene-4-phenyl-1H-pyridine-2-carboxamide

Systemtic Name: N-[[2-[2-azanyl-3,4-bis(oxidanylidene)cyclobuten-1-yl]-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-oxidanylidene-4-phenyl-1H-pyridine-2-carboxamide Openeye Name: N-[[2-(2-amino-3,4-dioxo-cyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-oxo-4-phenyl-1H-pyridine-2-carboxamide CAS Name: N-[[2-(2-amino-3,4-dioxo-1-cyclobutenyl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-oxo-4-phenyl-1H-pyridine-2-carboxamide IUPAC Name: N-[[2-(2-amino-3,4-dioxocyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-oxo-4-phenyl-1H-pyridine-2-carboxamide Traditional Name: N-[[2-(2-amino-3,4-diketo-cyclobuten-1-yl)-3,4-dihydro-1H-isoquinolin-7-yl]methyl]-6-keto-4-phenyl-1H-pyridine-2-carboxamide Formula: C26H22N4O4 MolecularWeight: 454.47728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)CNC(=O)C3=CC(=CC(=O)N3)C4=CC=CC=C4)C5=C(C(=O)C5=O)N

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)CNC(=O)C3=CC(=CC(=O)N3)C4=CC=CC=C4)C5=C(C(=O)C5=O)N

InChI

InChI=1S/C26H22N4O4/c27-22-23(25(33)24(22)32)30-9-8-17-7-6-15(10-19(17)14-30)13-28-26(34)20-11-18(12-21(31)29-20)16-4-2-1-3-5-16/h1-7,10-12H,8-9,13-14,27H2,(H,28,34)(H,29,31)