2-chloranyl-N-[2-(5-methylhexan-2-ylcarbamoyl)phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(5-methylhexan-2-ylcarbamoyl)phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-(1,4-dimethylpentylcarbamoyl)phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-[(5-methylhexan-2-ylamino)-oxomethyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(5-methylhexan-2-ylcarbamoyl)phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-(1,4-dimethylpentylcarbamoyl)phenyl]-4-nitro-benzamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H24ClN3O4/c1-13(2)8-9-14(3)23-21(27)17-6-4-5-7-19(17)24-20(26)16-11-10-15(25(28)29)12-18(16)22/h4-7,10-14H,8-9H2,1-3H3,(H,23,27)(H,24,26)