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

Systemtic Name: N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3-nitro-benzamide Openeye Name: N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3-nitro-benzamide CAS Name: N-[[2-[(4-ethyl-1-piperazinyl)methyl]phenyl]methyl]-3-nitrobenzamide IUPAC Name: N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-3-nitrobenzamide Traditional Name: N-[2-[(4-ethylpiperazino)methyl]benzyl]-3-nitro-benzamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O3/c1-2-23-10-12-24(13-11-23)16-19-7-4-3-6-18(19)15-22-21(26)17-8-5-9-20(14-17)25(27)28/h3-9,14H,2,10-13,15-16H2,1H3,(H,22,26)