methyl 4-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]benzoate

Systemtic Name: methyl 4-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]benzoate Openeye Name: methyl 4-[[1,3-dioxo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]benzoate CAS Name: 4-[[1,3-dioxo-2-(2-pyridinyl)-4-isoquinolinylidene]methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1,3-dioxo-2-pyridin-2-ylisoquinolin-4-ylidene)methylamino]benzoate Traditional Name: 4-[[1,3-diketo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]benzoic acid methyl ester Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C23H17N3O4/c1-30-23(29)15-9-11-16(12-10-15)25-14-19-17-6-2-3-7-18(17)21(27)26(22(19)28)20-8-4-5-13-24-20/h2-14,25H,1H3