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

Systemtic Name: 3-(3H-1,3-benzothiazol-2-ylidene)-4-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)butanoate Openeye Name: 3-(3H-1,3-benzothiazol-2-ylidene)-4-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)butanoate CAS Name: 3-(3H-1,3-benzothiazol-2-ylidene)-4-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)butanoate IUPAC Name: 3-(3H-1,3-benzothiazol-2-ylidene)-4-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)butanoate Traditional Name: 3-(3H-1,3-benzothiazol-2-ylidene)-4-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)butyrate Formula: C18H14NO4S- MolecularWeight: 340.37306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO4S/c1-23-15-9-11(6-7-14(15)20)8-12(10-17(21)22)18-19-13-4-2-3-5-16(13)24-18/h2-9,19H,10H2,1H3,(H,21,22)/p-1