methyl (5Z)-2,2-dimethyl-4,6-bis(oxidanylidene)-5-[(pyridin-4-ylamino)methylidene]cyclohexane-1-carboxylate

Systemtic Name: methyl (5Z)-2,2-dimethyl-4,6-bis(oxidanylidene)-5-[(pyridin-4-ylamino)methylidene]cyclohexane-1-carboxylate Openeye Name: methyl (5Z)-2,2-dimethyl-4,6-dioxo-5-[(4-pyridylamino)methylene]cyclohexanecarboxylate CAS Name: (5Z)-2,2-dimethyl-4,6-dioxo-5-[(pyridin-4-ylamino)methylidene]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-2,2-dimethyl-4,6-dioxo-5-[(pyridin-4-ylamino)methylidene]cyclohexane-1-carboxylate Traditional Name: (5Z)-4,6-diketo-2,2-dimethyl-5-[(4-pyridylamino)methylene]cyclohexanecarboxylic acid methyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=CC=NC=C2)C(=O)C1C(=O)OC)C

Isomeric SMILES

CC1(CC(=O)/C(=C/NC2=CC=NC=C2)/C(=O)C1C(=O)OC)C

InChI

InChI=1S/C16H18N2O4/c1-16(2)8-12(19)11(14(20)13(16)15(21)22-3)9-18-10-4-6-17-7-5-10/h4-7,9,13H,8H2,1-3H3,(H,17,18)/b11-9-