(3,4-dimethoxyphenyl)methyl 2-(2-diethylaminoethylsulfanyl)-2-phenyl-ethanoate

Systemtic Name: (3,4-dimethoxyphenyl)methyl 2-(2-diethylaminoethylsulfanyl)-2-phenyl-ethanoate Openeye Name: (3,4-dimethoxyphenyl)methyl 2-(2-diethylaminoethylsulfanyl)-2-phenyl-acetate CAS Name: 2-(2-diethylaminoethylthio)-2-phenylacetic acid (3,4-dimethoxyphenyl)methyl ester IUPAC Name: (3,4-dimethoxyphenyl)methyl 2-(2-diethylaminoethylsulfanyl)-2-phenylacetate Traditional Name: 2-(2-diethylaminoethylthio)-2-phenyl-acetic acid veratryl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC(C1=CC=CC=C1)C(=O)OCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCN(CC)CCSC(C1=CC=CC=C1)C(=O)OCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C23H31NO4S/c1-5-24(6-2)14-15-29-22(19-10-8-7-9-11-19)23(25)28-17-18-12-13-20(26-3)21(16-18)27-4/h7-13,16,22H,5-6,14-15,17H2,1-4H3