methyl 3-[5-[(E)-3-[(3-methylsulfonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate

Systemtic Name: methyl 3-[5-[(E)-3-[(3-methylsulfonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]propanoate Openeye Name: methyl 3-[5-[(E)-3-(3-methylsulfonylanilino)-3-oxo-prop-1-enyl]-2-furyl]propanoate CAS Name: 3-[5-[(E)-3-(3-methylsulfonylanilino)-3-oxoprop-1-enyl]-2-furanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-3-(3-methylsulfonylanilino)-3-oxoprop-1-enyl]furan-2-yl]propanoate Traditional Name: 3-[5-[(E)-3-keto-3-(3-mesylanilino)prop-1-enyl]-2-furyl]propionic acid methyl ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(O1)C=CC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)CCC1=CC=C(O1)/C=C/C(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H19NO6S/c1-24-18(21)11-9-15-7-6-14(25-15)8-10-17(20)19-13-4-3-5-16(12-13)26(2,22)23/h3-8,10,12H,9,11H2,1-2H3,(H,19,20)/b10-8+