N-(2-chloranyl-4-nitro-phenyl)-5-(4-cyanophenyl)carbonyl-3-methyl-2-oxidanyl-benzamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-5-(4-cyanophenyl)carbonyl-3-methyl-2-oxidanyl-benzamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-5-(4-cyanobenzoyl)-2-hydroxy-3-methyl-benzamide CAS Name: N-(2-chloro-4-nitrophenyl)-5-[(4-cyanophenyl)-oxomethyl]-2-hydroxy-3-methylbenzamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-5-(4-cyanobenzoyl)-2-hydroxy-3-methylbenzamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-5-(4-cyanobenzoyl)-2-hydroxy-3-methyl-benzamide Formula: C22H14ClN3O5 MolecularWeight: 435.81666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=CC(=C1O)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H14ClN3O5/c1-12-8-15(21(28)14-4-2-13(11-24)3-5-14)9-17(20(12)27)22(29)25-19-7-6-16(26(30)31)10-18(19)23/h2-10,27H,1H3,(H,25,29)