3-[(3,4-dimethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]propanoate

Systemtic Name: 3-[(3,4-dimethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]propanoate Openeye Name: 3-[(3,4-dimethoxyphenyl)sulfonyl-(2-furylmethyl)amino]propanoate CAS Name: 3-[(3,4-dimethoxyphenyl)sulfonyl-(2-furanylmethyl)amino]propanoate IUPAC Name: 3-[(3,4-dimethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]propanoate Traditional Name: 3-[(3,4-dimethoxyphenyl)sulfonyl-(2-furfuryl)amino]propionate Formula: C16H18NO7S- MolecularWeight: 368.38162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CC2=CC=CO2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CC2=CC=CO2)OC

InChI

InChI=1S/C16H19NO7S/c1-22-14-6-5-13(10-15(14)23-2)25(20,21)17(8-7-16(18)19)11-12-4-3-9-24-12/h3-6,9-10H,7-8,11H2,1-2H3,(H,18,19)/p-1