2-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]isoindole-1,3-dione

Systemtic Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]isoindole-1,3-dione Openeye Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]isoindoline-1,3-dione CAS Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]isoindole-1,3-dione IUPAC Name: 2-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]isoindole-1,3-dione Traditional Name: 2-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]isoindoline-1,3-quinone Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNN2C(=O)C3=CC=CC=C3C2=O)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNN2C(=O)C3=CC=CC=C3C2=O)C1=O)CO

InChI

InChI=1S/C16H13N3O4/c1-9-14(21)13(10(8-20)6-17-9)7-18-19-15(22)11-4-2-3-5-12(11)16(19)23/h2-7,18,20H,8H2,1H3