(Z)-3-[(E)-2-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)ethenyl]oct-2-enoic acid

Systemtic Name: (Z)-3-[(E)-2-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)ethenyl]oct-2-enoic acid Openeye Name: (Z)-3-[(E)-2-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)vinyl]oct-2-enoic acid CAS Name: (Z)-3-[(E)-2-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)ethenyl]-2-octenoic acid IUPAC Name: (Z)-3-[(E)-2-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)ethenyl]oct-2-enoic acid Traditional Name: (2Z,4E)-3-amyl-5-(7-methoxy-3,3-dimethyl-2H-1-benzoxepin-5-yl)penta-2,4-dienoic acid Formula: C23H30O4 MolecularWeight: 370.4819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC(=O)O)C=CC1=CC(COC2=C1C=C(C=C2)OC)(C)C

Isomeric SMILES

CCCCC/C(=C/C(=O)O)/C=C/C1=CC(COC2=C1C=C(C=C2)OC)(C)C

InChI

InChI=1S/C23H30O4/c1-5-6-7-8-17(13-22(24)25)9-10-18-15-23(2,3)16-27-21-12-11-19(26-4)14-20(18)21/h9-15H,5-8,16H2,1-4H3,(H,24,25)/b10-9+,17-13-