2-chloranyl-N-[2-(hexylcarbamoyl)phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(hexylcarbamoyl)phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-(hexylcarbamoyl)phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-[(hexylamino)-oxomethyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(hexylcarbamoyl)phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-(hexylcarbamoyl)phenyl]-4-nitro-benzamide Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O4/c1-2-3-4-7-12-22-19(25)16-8-5-6-9-18(16)23-20(26)15-11-10-14(24(27)28)13-17(15)21/h5-6,8-11,13H,2-4,7,12H2,1H3,(H,22,25)(H,23,26)