3-[[(5Z)-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 3-[[(5Z)-4-oxidanylidene-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 3-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylene]thiazol-2-yl]amino]benzoic acid CAS Name: 3-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylidene]-2-thiazolyl]amino]benzoic acid IUPAC Name: 3-[[(5Z)-4-oxo-5-[(4-propoxyphenyl)methylidene]-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 3-[[(5Z)-4-keto-5-(4-propoxybenzylidene)-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C\2/C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H18N2O4S/c1-2-10-26-16-8-6-13(7-9-16)11-17-18(23)22-20(27-17)21-15-5-3-4-14(12-15)19(24)25/h3-9,11-12H,2,10H2,1H3,(H,24,25)(H,21,22,23)/b17-11-