N-[4-(butanoylamino)phenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[4-(butanoylamino)phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(butanoylamino)phenyl]-2-methyl-3-nitro-benzamide CAS Name: 2-methyl-3-nitro-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: N-[4-(butanoylamino)phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-(4-butyramidophenyl)-2-methyl-3-nitro-benzamide Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4/c1-3-5-17(22)19-13-8-10-14(11-9-13)20-18(23)15-6-4-7-16(12(15)2)21(24)25/h4,6-11H,3,5H2,1-2H3,(H,19,22)(H,20,23)