N-[5-methyl-2-(pentanoylamino)phenyl]-3-nitro-benzamide

Systemtic Name: N-[5-methyl-2-(pentanoylamino)phenyl]-3-nitro-benzamide Openeye Name: N-[5-methyl-2-(pentanoylamino)phenyl]-3-nitro-benzamide CAS Name: N-[5-methyl-2-(1-oxopentylamino)phenyl]-3-nitrobenzamide IUPAC Name: N-[5-methyl-2-(pentanoylamino)phenyl]-3-nitrobenzamide Traditional Name: N-[5-methyl-2-(valerylamino)phenyl]-3-nitro-benzamide Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4/c1-3-4-8-18(23)20-16-10-9-13(2)11-17(16)21-19(24)14-6-5-7-15(12-14)22(25)26/h5-7,9-12H,3-4,8H2,1-2H3,(H,20,23)(H,21,24)