N-[4-(butanoylamino)phenyl]-3-nitro-benzamide

Systemtic Name: N-[4-(butanoylamino)phenyl]-3-nitro-benzamide Openeye Name: N-[4-(butanoylamino)phenyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: N-[4-(butanoylamino)phenyl]-3-nitrobenzamide Traditional Name: N-(4-butyramidophenyl)-3-nitro-benzamide Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4/c1-2-4-16(21)18-13-7-9-14(10-8-13)19-17(22)12-5-3-6-15(11-12)20(23)24/h3,5-11H,2,4H2,1H3,(H,18,21)(H,19,22)