2-[3-(4-dimethylaminophenyl)imino-5-isocyano-4-methyl-2,6-bis(oxidanylidene)pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-dimethylaminophenyl)imino-5-isocyano-4-methyl-2,6-bis(oxidanylidene)pyridin-1-yl]ethanoic acid Openeye Name: 2-[3-(4-dimethylaminophenyl)imino-5-isocyano-4-methyl-2,6-dioxo-1-pyridyl]acetic acid CAS Name: 2-[3-(4-dimethylaminophenyl)imino-5-isocyano-4-methyl-2,6-dioxo-1-pyridinyl]acetic acid IUPAC Name: 2-[3-(4-dimethylaminophenyl)imino-5-isocyano-4-methyl-2,6-dioxopyridin-1-yl]acetic acid Traditional Name: 2-[3-(4-dimethylaminophenyl)imino-5-isocyano-2,6-diketo-4-methyl-1-pyridyl]acetic acid Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)C1=NC2=CC=C(C=C2)N(C)C)CC(=O)O)[N+]#[C-]

Isomeric SMILES

CC1=C(C(=O)N(C(=O)C1=NC2=CC=C(C=C2)N(C)C)CC(=O)O)[N+]#[C-]

InChI

InChI=1S/C17H16N4O4/c1-10-14(18-2)16(24)21(9-13(22)23)17(25)15(10)19-11-5-7-12(8-6-11)20(3)4/h5-8H,9H2,1,3-4H3,(H,22,23)