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

Systemtic Name: 4-[(E)-3-(1-heptyl-4,4-dimethyl-2-oxidanylidene-3H-quinolin-6-yl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(1-heptyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(1-heptyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(1-heptyl-4,4-dimethyl-2-oxo-3H-quinolin-6-yl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(1-heptyl-2-keto-4,4-dimethyl-3H-quinolin-6-yl)-3-keto-prop-1-enyl]benzoic acid Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)CC(C2=C1C=CC(=C2)C(=O)C=CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CCCCCCCN1C(=O)CC(C2=C1C=CC(=C2)C(=O)/C=C/C3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C28H33NO4/c1-4-5-6-7-8-17-29-24-15-14-22(18-23(24)28(2,3)19-26(29)31)25(30)16-11-20-9-12-21(13-10-20)27(32)33/h9-16,18H,4-8,17,19H2,1-3H3,(H,32,33)/b16-11+