3-nitro-N-(phenylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide

Systemtic Name: 3-nitro-N-(phenylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Openeye Name: N-benzyl-3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]benzamide CAS Name: 3-nitro-N-(phenylmethyl)-4-[4-(2-pyridinyl)-1-piperazinyl]benzamide IUPAC Name: N-benzyl-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Traditional Name: N-benzyl-3-nitro-4-[4-(2-pyridyl)piperazino]benzamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C23H23N5O3/c29-23(25-17-18-6-2-1-3-7-18)19-9-10-20(21(16-19)28(30)31)26-12-14-27(15-13-26)22-8-4-5-11-24-22/h1-11,16H,12-15,17H2,(H,25,29)