4-[(E)-3-(3,5-ditert-butyl-4-methoxy-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(3,5-ditert-butyl-4-methoxy-phenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(3,5-ditert-butyl-4-methoxy-phenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(3,5-ditert-butyl-4-methoxyphenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(3,5-ditert-butyl-4-methoxyphenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(3,5-ditert-butyl-4-methoxy-phenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C25H30O4 MolecularWeight: 394.5033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)C=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)C(=O)/C=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C25H30O4/c1-24(2,3)19-14-18(15-20(22(19)29-7)25(4,5)6)21(26)13-10-16-8-11-17(12-9-16)23(27)28/h8-15H,1-7H3,(H,27,28)/b13-10+