2-nitro-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]aniline

Systemtic Name: 2-nitro-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]aniline Openeye Name: N-[3-(4-benzyl-1-piperidyl)propyl]-2-nitro-aniline CAS Name: 2-nitro-N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]aniline IUPAC Name: N-[3-(4-benzylpiperidin-1-yl)propyl]-2-nitroaniline Traditional Name: 3-(4-benzylpiperidino)propyl-(2-nitrophenyl)amine Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O2/c25-24(26)21-10-5-4-9-20(21)22-13-6-14-23-15-11-19(12-16-23)17-18-7-2-1-3-8-18/h1-5,7-10,19,22H,6,11-17H2