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

Systemtic Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-3-phenyl-propylidene]-2-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenyl-propylidene]-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenylpropylidene]-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-3-phenylpropylidene]-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-3-phenyl-propylidene]-2-nitro-cyclohexa-2,5-dien-1-one Formula: C22H14N2O4S MolecularWeight: 402.42256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=C2NC3=CC=CC=C3S2)C=C4C=CC(=O)C(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(=C2NC3=CC=CC=C3S2)C=C4C=CC(=O)C(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O4S/c25-19-11-10-14(13-18(19)24(27)28)12-16(21(26)15-6-2-1-3-7-15)22-23-17-8-4-5-9-20(17)29-22/h1-13,23H