ethyl 6-[4-(3-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]-6-oxidanylidene-hexanoate

Systemtic Name: ethyl 6-[4-(3-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]-6-oxidanylidene-hexanoate Openeye Name: ethyl 6-[4-(3-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]-6-oxo-hexanoate CAS Name: 6-[4-[(3-methyl-1-cyclohexa-1,3-dienyl)oxy]phenyl]-6-oxohexanoic acid ethyl ester IUPAC Name: ethyl 6-[4-(3-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]-6-oxohexanoate Traditional Name: 6-keto-6-[4-(3-methylcyclohexa-1,3-dien-1-yl)oxyphenyl]hexanoic acid ethyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)C1=CC=C(C=C1)OC2=CC(=CCC2)C

Isomeric SMILES

CCOC(=O)CCCCC(=O)C1=CC=C(C=C1)OC2=CC(=CCC2)C

InChI

InChI=1S/C21H26O4/c1-3-24-21(23)10-5-4-9-20(22)17-11-13-18(14-12-17)25-19-8-6-7-16(2)15-19/h7,11-15H,3-6,8-10H2,1-2H3