4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-3-phenyl-propylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-3-phenyl-propylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenyl-propylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenylpropylidene]-2-methoxy-6-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenylpropylidene]-2-methoxy-6-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-3-phenyl-propylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one Formula: C23H16N2O5S MolecularWeight: 432.44854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C2NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4)C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O5S/c1-30-19-13-14(12-18(22(19)27)25(28)29)11-16(21(26)15-7-3-2-4-8-15)23-24-17-9-5-6-10-20(17)31-23/h2-13,24H,1H3