4-[(2E)-2-(6-oxidanylidene-3-pentan-3-yl-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-(6-oxidanylidene-3-pentan-3-yl-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[3-(1-ethylpropyl)-6-oxo-cyclohexa-2,4-dien-1-ylidene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-(6-oxo-3-pentan-3-yl-1-cyclohexa-2,4-dienylidene)hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-(6-oxo-3-pentan-3-ylcyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-[3-(1-ethylpropyl)-6-keto-cyclohexa-2,4-dien-1-ylidene]hydrazino]benzoic acid Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC(=NNC2=CC=C(C=C2)C(=O)O)C(=O)C=C1

Isomeric SMILES

CCC(CC)C1=C/C(=N\NC2=CC=C(C=C2)C(=O)O)/C(=O)C=C1

InChI

InChI=1S/C18H20N2O3/c1-3-12(4-2)14-7-10-17(21)16(11-14)20-19-15-8-5-13(6-9-15)18(22)23/h5-12,19H,3-4H2,1-2H3,(H,22,23)/b20-16+