[(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl 2-chloranylbenzoate

Systemtic Name: [(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl 2-chloranylbenzoate Openeye Name: [(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl ester IUPAC Name: [(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [(1S,3S)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropyl]methyl ester Formula: C17H21ClO2 MolecularWeight: 292.80044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)COC(=O)C2=CC=CC=C2Cl)C

Isomeric SMILES

CC(=C[C@H]1[C@@H](C1(C)C)COC(=O)C2=CC=CC=C2Cl)C

InChI

InChI=1S/C17H21ClO2/c1-11(2)9-13-14(17(13,3)4)10-20-16(19)12-7-5-6-8-15(12)18/h5-9,13-14H,10H2,1-4H3/t13-,14-/m0/s1