N-(2-chloranyl-5-methoxy-phenyl)-4-nitro-benzenecarbothioamide

Systemtic Name: N-(2-chloranyl-5-methoxy-phenyl)-4-nitro-benzenecarbothioamide Openeye Name: N-(2-chloro-5-methoxy-phenyl)-4-nitro-benzenecarbothioamide CAS Name: N-(2-chloro-5-methoxyphenyl)-4-nitrobenzenecarbothioamide IUPAC Name: N-(2-chloro-5-methoxyphenyl)-4-nitrobenzenecarbothioamide Traditional Name: N-(2-chloro-5-methoxy-phenyl)-4-nitro-thiobenzamide Formula: C14H11ClN2O3S MolecularWeight: 322.76674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)NC(=S)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)NC(=S)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN2O3S/c1-20-11-6-7-12(15)13(8-11)16-14(21)9-2-4-10(5-3-9)17(18)19/h2-8H,1H3,(H,16,21)