2-methoxy-5-[[2-(4-methoxyphenyl)sulfanylethanoylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[2-(4-methoxyphenyl)sulfanylethanoylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[[2-(4-methoxyphenyl)sulfanylacetyl]amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[2-[(4-methoxyphenyl)thio]-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[2-(4-methoxyphenyl)sulfanylacetyl]amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[[2-[(4-methoxyphenyl)thio]acetyl]amino]methyl]benzoic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C18H19NO5S/c1-23-13-4-6-14(7-5-13)25-11-17(20)19-10-12-3-8-16(24-2)15(9-12)18(21)22/h3-9H,10-11H2,1-2H3,(H,19,20)(H,21,22)