2-nitro-N-(phenylmethyl)-5-(4-pyridin-2-ylpiperazin-1-yl)aniline

Systemtic Name: 2-nitro-N-(phenylmethyl)-5-(4-pyridin-2-ylpiperazin-1-yl)aniline Openeye Name: N-benzyl-2-nitro-5-[4-(2-pyridyl)piperazin-1-yl]aniline CAS Name: 2-nitro-N-(phenylmethyl)-5-[4-(2-pyridinyl)-1-piperazinyl]aniline IUPAC Name: N-benzyl-2-nitro-5-(4-pyridin-2-ylpiperazin-1-yl)aniline Traditional Name: benzyl-[2-nitro-5-[4-(2-pyridyl)piperazino]phenyl]amine Formula: C22H23N5O2 MolecularWeight: 389.45032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O2/c28-27(29)21-10-9-19(16-20(21)24-17-18-6-2-1-3-7-18)25-12-14-26(15-13-25)22-8-4-5-11-23-22/h1-11,16,24H,12-15,17H2