(E)-4-[(2-hexylphenyl)methoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(2-hexylphenyl)methoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(2-hexylphenyl)methoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(2-hexylphenyl)methoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(2-hexylphenyl)methoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-(2-hexylbenzyl)oxy-4-keto-but-2-enoic acid Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1COC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCC1=CC=CC=C1COC(=O)/C=C/C(=O)O

InChI

InChI=1S/C17H22O4/c1-2-3-4-5-8-14-9-6-7-10-15(14)13-21-17(20)12-11-16(18)19/h6-7,9-12H,2-5,8,13H2,1H3,(H,18,19)/b12-11+