(2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 5,5-bis(chloranyl)-3-methyl-2-propan-2-yl-pent-4-enoate

Systemtic Name: (2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 5,5-bis(chloranyl)-3-methyl-2-propan-2-yl-pent-4-enoate Openeye Name: (2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 5,5-dichloro-2-isopropyl-3-methyl-pent-4-enoate CAS Name: 5,5-dichloro-3-methyl-2-propan-2-yl-4-pentenoic acid (2,6-dimethyl-4-prop-2-ynylphenyl)methyl ester IUPAC Name: (2,6-dimethyl-4-prop-2-ynylphenyl)methyl 5,5-dichloro-3-methyl-2-propan-2-ylpent-4-enoate Traditional Name: 5,5-dichloro-2-isopropyl-3-methyl-pent-4-enoic acid (2,6-dimethyl-4-propargyl-benzyl) ester Formula: C21H26Cl2O2 MolecularWeight: 381.33594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C(C(C)C)C(C)C=C(Cl)Cl)C)CC#C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C(C(C)C)C(C)C=C(Cl)Cl)C)CC#C

InChI

InChI=1S/C21H26Cl2O2/c1-7-8-17-9-14(4)18(15(5)10-17)12-25-21(24)20(13(2)3)16(6)11-19(22)23/h1,9-11,13,16,20H,8,12H2,2-6H3