2-[(2Z)-2-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-6-yl]ethanoic acid

Systemtic Name: 2-[(2Z)-2-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-6-yl]ethanoic acid Openeye Name: 2-[(2Z)-2-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-6-yl]acetic acid CAS Name: 2-[(2Z)-2-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-3H-1,3-benzothiazol-6-yl]acetic acid IUPAC Name: 2-[(2Z)-2-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-6-yl]acetic acid Traditional Name: 2-[(2Z)-2-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-3H-1,3-benzothiazol-6-yl]acetic acid Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2NC3=C(S2)C=C(C=C3)CC(=O)O)C1=O

Isomeric SMILES

CC1=CC=C/C(=C/2\NC3=C(S2)C=C(C=C3)CC(=O)O)/C1=O

InChI

InChI=1S/C16H13NO3S/c1-9-3-2-4-11(15(9)20)16-17-12-6-5-10(8-14(18)19)7-13(12)21-16/h2-7,17H,8H2,1H3,(H,18,19)/b16-11-