methyl 5-(2-chloroethyl)-3-ethyl-4-(methoxymethyl)-2-oxidanyl-6-phenyl-benzoate

Systemtic Name: methyl 5-(2-chloroethyl)-3-ethyl-4-(methoxymethyl)-2-oxidanyl-6-phenyl-benzoate Openeye Name: methyl 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(methoxymethyl)-6-phenyl-benzoate CAS Name: 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(methoxymethyl)-6-phenylbenzoic acid methyl ester IUPAC Name: methyl 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(methoxymethyl)-6-phenylbenzoate Traditional Name: 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(methoxymethyl)-6-phenyl-benzoic acid methyl ester Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1COC)CCCl)C2=CC=CC=C2)C(=O)OC)O

Isomeric SMILES

CCC1=C(C(=C(C(=C1COC)CCCl)C2=CC=CC=C2)C(=O)OC)O

InChI

InChI=1S/C20H23ClO4/c1-4-14-16(12-24-2)15(10-11-21)17(13-8-6-5-7-9-13)18(19(14)22)20(23)25-3/h5-9,22H,4,10-12H2,1-3H3