4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pentanoate

Systemtic Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)pentanoate Openeye Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)pentanoate CAS Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)pentanoate IUPAC Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)pentanoate Traditional Name: 4-(3H-1,3-benzothiazol-2-ylidene)-5-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)valerate Formula: C19H16NO4S- MolecularWeight: 354.39964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)CCC(=O)[O-])C=CC1=O

Isomeric SMILES

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)CCC(=O)[O-])C=CC1=O

InChI

InChI=1S/C19H17NO4S/c1-24-16-11-12(6-8-15(16)21)10-13(7-9-18(22)23)19-20-14-4-2-3-5-17(14)25-19/h2-6,8,10-11,20H,7,9H2,1H3,(H,22,23)/p-1