[(E)-1-(5-chloranylthiophen-2-yl)ethylideneamino] 3-nitrobenzoate

Systemtic Name: [(E)-1-(5-chloranylthiophen-2-yl)ethylideneamino] 3-nitrobenzoate Openeye Name: [(E)-1-(5-chloro-2-thienyl)ethylideneamino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(E)-1-(5-chloro-2-thiophenyl)ethylideneamino] ester IUPAC Name: [(E)-1-(5-chlorothiophen-2-yl)ethylideneamino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(E)-1-(5-chloro-2-thienyl)ethylideneamino] ester Formula: C13H9ClN2O4S MolecularWeight: 324.73956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=C(S2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClN2O4S/c1-8(11-5-6-12(14)21-11)15-20-13(17)9-3-2-4-10(7-9)16(18)19/h2-7H,1H3/b15-8+