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

Systemtic Name: 2-nitro-N-[4-[4-(phenylmethyl)piperidin-1-yl]butyl]aniline Openeye Name: N-[4-(4-benzyl-1-piperidyl)butyl]-2-nitro-aniline CAS Name: 2-nitro-N-[4-[4-(phenylmethyl)-1-piperidinyl]butyl]aniline IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)butyl]-2-nitroaniline Traditional Name: 4-(4-benzylpiperidino)butyl-(2-nitrophenyl)amine Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H29N3O2/c26-25(27)22-11-5-4-10-21(22)23-14-6-7-15-24-16-12-20(13-17-24)18-19-8-2-1-3-9-19/h1-5,8-11,20,23H,6-7,12-18H2