N-[3-(butan-2-ylcarbamoyl)-4-piperidin-1-yl-phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[3-(butan-2-ylcarbamoyl)-4-piperidin-1-yl-phenyl]-4-methyl-3-nitro-benzamide Openeye Name: 4-methyl-3-nitro-N-[4-(1-piperidyl)-3-(sec-butylcarbamoyl)phenyl]benzamide CAS Name: N-[3-[(butan-2-ylamino)-oxomethyl]-4-(1-piperidinyl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[3-(butan-2-ylcarbamoyl)-4-piperidin-1-ylphenyl]-4-methyl-3-nitrobenzamide Traditional Name: 4-methyl-3-nitro-N-[4-piperidino-3-(sec-butylcarbamoyl)phenyl]benzamide Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C24H30N4O4/c1-4-17(3)25-24(30)20-15-19(10-11-21(20)27-12-6-5-7-13-27)26-23(29)18-9-8-16(2)22(14-18)28(31)32/h8-11,14-15,17H,4-7,12-13H2,1-3H3,(H,25,30)(H,26,29)