(E)-3-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-chloro-4-hexoxy-5-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-chloro-4-hexoxy-5-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-chloro-4-hexoxy-5-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-chloro-4-hexoxy-5-methoxy-phenyl)acrylic acid Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C=CC(=O)O)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)/C=C/C(=O)O)OC

InChI

InChI=1S/C16H21ClO4/c1-3-4-5-6-9-21-16-13(17)10-12(7-8-15(18)19)11-14(16)20-2/h7-8,10-11H,3-6,9H2,1-2H3,(H,18,19)/b8-7+