4-[[2-(6-nitro-1,3-benzothiazol-2-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2-(6-nitro-1,3-benzothiazol-2-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(6-nitro-1,3-benzothiazol-2-yl)hydrazino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[(6-nitro-1,3-benzothiazol-2-yl)hydrazo]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(6-nitro-1,3-benzothiazol-2-yl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-(6-nitro-1,3-benzothiazol-2-yl)hydrazino]methylene]cyclohexa-2,5-dien-1-one Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=CNNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=CNNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3S/c19-11-4-1-9(2-5-11)8-15-17-14-16-12-6-3-10(18(20)21)7-13(12)22-14/h1-8,15H,(H,16,17)