4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pentanoic acid

Systemtic Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pentanoic acid Openeye Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)pentanoic acid CAS Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)pentanoic acid IUPAC Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)pentanoic acid Traditional Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)valeric acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C2NC3=CC=CC=C3S2)CCC(=O)O)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CC(=C2NC3=CC=CC=C3S2)CCC(=O)O)C=CC1=O

InChI

InChI=1S/C20H19NO4S/c1-2-25-17-12-13(7-9-16(17)22)11-14(8-10-19(23)24)20-21-15-5-3-4-6-18(15)26-20/h3-7,9,11-12,21H,2,8,10H2,1H3,(H,23,24)