4-[(E)-3-(1-hexyl-4,4-dimethyl-2-oxidanylidene-3H-quinolin-6-yl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(1-hexyl-4,4-dimethyl-2-oxidanylidene-3H-quinolin-6-yl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(1-hexyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(1-hexyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(1-hexyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(1-hexyl-2-keto-4,4-dimethyl-3H-quinolin-6-yl)-3-keto-prop-1-enyl]benzoic acid Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)CC(C2=C1C=CC(=C2)C(=O)C=CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CCCCCCN1C(=O)CC(C2=C1C=CC(=C2)C(=O)/C=C/C3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C27H31NO4/c1-4-5-6-7-16-28-23-14-13-21(17-22(23)27(2,3)18-25(28)30)24(29)15-10-19-8-11-20(12-9-19)26(31)32/h8-15,17H,4-7,16,18H2,1-3H3,(H,31,32)/b15-10+