[(E)-[azanyl-(5-nitro-1,3-thiazol-2-yl)methylidene]amino] 4-chloranylbenzoate

Systemtic Name: [(E)-[azanyl-(5-nitro-1,3-thiazol-2-yl)methylidene]amino] 4-chloranylbenzoate Openeye Name: [(E)-[amino-(5-nitrothiazol-2-yl)methylene]amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(E)-[amino-(5-nitro-2-thiazolyl)methylidene]amino] ester IUPAC Name: [(E)-[amino-(5-nitro-1,3-thiazol-2-yl)methylidene]amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(E)-[amino-(5-nitrothiazol-2-yl)methylene]amino] ester Formula: C11H7ClN4O4S MolecularWeight: 326.71568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)ON=C(C2=NC=C(S2)[N+](=O)[O-])N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O/N=C(\C2=NC=C(S2)[N+](=O)[O-])/N)Cl

InChI

InChI=1S/C11H7ClN4O4S/c12-7-3-1-6(2-4-7)11(17)20-15-9(13)10-14-5-8(21-10)16(18)19/h1-5H,(H2,13,15)