(2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid Openeye Name: (2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid CAS Name: (2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid IUPAC Name: (2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid Traditional Name: (2E,4E)-3-methyl-5-(3,3,7-trimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid Formula: C19H22O3 MolecularWeight: 298.37618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(C=C2C=CC(=CC(=O)O)C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(C=C2/C=C/C(=C/C(=O)O)/C)(C)C

InChI

InChI=1S/C19H22O3/c1-13-6-8-17-16(9-13)15(11-19(3,4)12-22-17)7-5-14(2)10-18(20)21/h5-11H,12H2,1-4H3,(H,20,21)/b7-5+,14-10+