N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-4-nitro-benzamide CAS Name: 3-methyl-4-nitro-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-(4-butyrylpiperazino)phenyl]-3-methyl-4-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O4/c1-3-4-21(27)25-13-11-24(12-14-25)19-8-6-18(7-9-19)23-22(28)17-5-10-20(26(29)30)16(2)15-17/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,28)