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2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate

2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate

Systemtic Name:2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate
Openeye Name:2-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate
CAS Name:2-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1,3-benzothiazol-4-olate
IUPAC Name:2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate
Traditional Name:2-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-4-olate
Formula: C14H8N3O4S-
MolecularWeight: 314.29602
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=N2)NC=C3C=C(C=CC3=O)[N+](=O)[O-])[O-]


Isomeric SMILES

C1=CC(=C2C(=C1)SC(=N2)NC=C3C=C(C=CC3=O)[N+](=O)[O-])[O-]


InChI

InChI=1S/C14H9N3O4S/c18-10-5-4-9(17(20)21)6-8(10)7-15-14-16-13-11(19)2-1-3-12(13)22-14/h1-7,19H,(H,15,16)/p-1


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