methyl 4-[[3-(1,3-benzothiazol-2-yloxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[3-(1,3-benzothiazol-2-yloxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[3-(1,3-benzothiazol-2-yloxy)anilino]-4-oxo-butanoate CAS Name: 4-[3-(1,3-benzothiazol-2-yloxy)anilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-benzothiazol-2-yloxy)anilino]-4-oxobutanoate Traditional Name: 4-[3-(1,3-benzothiazol-2-yloxy)anilino]-4-keto-butyric acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC1=CC(=CC=C1)OC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)CCC(=O)NC1=CC(=CC=C1)OC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N2O4S/c1-23-17(22)10-9-16(21)19-12-5-4-6-13(11-12)24-18-20-14-7-2-3-8-15(14)25-18/h2-8,11H,9-10H2,1H3,(H,19,21)