methyl 3-(2-chloroethyl)-2-methyl-6-oxidanyl-4-(phenylmethoxymethyl)-5-prop-2-enyl-benzoate

Systemtic Name: methyl 3-(2-chloroethyl)-2-methyl-6-oxidanyl-4-(phenylmethoxymethyl)-5-prop-2-enyl-benzoate Openeye Name: methyl 3-allyl-4-(benzyloxymethyl)-5-(2-chloroethyl)-2-hydroxy-6-methyl-benzoate CAS Name: 5-(2-chloroethyl)-2-hydroxy-6-methyl-4-(phenylmethoxymethyl)-3-prop-2-enylbenzoic acid methyl ester IUPAC Name: methyl 5-(2-chloroethyl)-2-hydroxy-6-methyl-4-(phenylmethoxymethyl)-3-prop-2-enylbenzoate Traditional Name: 3-allyl-4-(benzoxymethyl)-5-(2-chloroethyl)-2-hydroxy-6-methyl-benzoic acid methyl ester Formula: C22H25ClO4 MolecularWeight: 388.8845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1CCCl)COCC2=CC=CC=C2)CC=C)O)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C(=C1CCCl)COCC2=CC=CC=C2)CC=C)O)C(=O)OC

InChI

InChI=1S/C22H25ClO4/c1-4-8-18-19(14-27-13-16-9-6-5-7-10-16)17(11-12-23)15(2)20(21(18)24)22(25)26-3/h4-7,9-10,24H,1,8,11-14H2,2-3H3