methyl 3-azanyl-4-(2,2-dimethoxy-1-methylsulfanyl-ethyl)-2-methyl-benzoate

Systemtic Name: methyl 3-azanyl-4-(2,2-dimethoxy-1-methylsulfanyl-ethyl)-2-methyl-benzoate Openeye Name: methyl 3-amino-4-(2,2-dimethoxy-1-methylsulfanyl-ethyl)-2-methyl-benzoate CAS Name: 3-amino-4-[2,2-dimethoxy-1-(methylthio)ethyl]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-amino-4-(2,2-dimethoxy-1-methylsulfanylethyl)-2-methylbenzoate Traditional Name: 3-amino-4-[2,2-dimethoxy-1-(methylthio)ethyl]-2-methyl-benzoic acid methyl ester Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N)C(C(OC)OC)SC)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1N)C(C(OC)OC)SC)C(=O)OC

InChI

InChI=1S/C14H21NO4S/c1-8-9(13(16)17-2)6-7-10(11(8)15)12(20-5)14(18-3)19-4/h6-7,12,14H,15H2,1-5H3