(6E)-6-[(2Z)-2-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid

Systemtic Name: (6E)-6-[(2Z)-2-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid Openeye Name: (6E)-6-[(2Z)-2-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid CAS Name: (6E)-6-[(2Z)-2-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid IUPAC Name: (6E)-6-[(2Z)-2-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid Traditional Name: (6E)-6-[(2Z)-2-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)cyclopentylidene]-1H-pyrazine-2-carboxylic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCCC2=C3C=NC=C(N3)C(=O)O)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C/2\CCC\C2=C/3\C=NC=C(N3)C(=O)O)/C(=O)C=C1

InChI

InChI=1S/C17H16N2O3/c1-10-5-6-16(20)13(7-10)11-3-2-4-12(11)14-8-18-9-15(19-14)17(21)22/h5-9,19H,2-4H2,1H3,(H,21,22)/b13-11-,14-12+