N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]-4-methyl-3-nitro-benzamide Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O4/c1-4-18(5-2)24(30)27-14-12-26(13-15-27)21-10-8-20(9-11-21)25-23(29)19-7-6-17(3)22(16-19)28(31)32/h6-11,16,18H,4-5,12-15H2,1-3H3,(H,25,29)