6-methylheptyl 4-(6-chloranyl-6-methyl-cyclohexa-2,4-dien-1-yl)oxybutanoate

Systemtic Name: 6-methylheptyl 4-(6-chloranyl-6-methyl-cyclohexa-2,4-dien-1-yl)oxybutanoate Openeye Name: 6-methylheptyl 4-(6-chloro-6-methyl-cyclohexa-2,4-dien-1-yl)oxybutanoate CAS Name: 4-[(6-chloro-6-methyl-1-cyclohexa-2,4-dienyl)oxy]butanoic acid 6-methylheptyl ester IUPAC Name: 6-methylheptyl 4-(6-chloro-6-methylcyclohexa-2,4-dien-1-yl)oxybutanoate Traditional Name: 4-(6-chloro-6-methyl-cyclohexa-2,4-dien-1-yl)oxybutyric acid 6-methylheptyl ester Formula: C19H31ClO3 MolecularWeight: 342.90064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)CCCOC1C=CC=CC1(C)Cl

Isomeric SMILES

CC(C)CCCCCOC(=O)CCCOC1C=CC=CC1(C)Cl

InChI

InChI=1S/C19H31ClO3/c1-16(2)10-5-4-8-14-23-18(21)12-9-15-22-17-11-6-7-13-19(17,3)20/h6-7,11,13,16-17H,4-5,8-10,12,14-15H2,1-3H3