N-[(4-tert-butylphenyl)methyl]-2-nitro-5-piperidin-1-yl-aniline

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-2-nitro-5-piperidin-1-yl-aniline Openeye Name: N-[(4-tert-butylphenyl)methyl]-2-nitro-5-(1-piperidyl)aniline CAS Name: N-[(4-tert-butylphenyl)methyl]-2-nitro-5-(1-piperidinyl)aniline IUPAC Name: N-[(4-tert-butylphenyl)methyl]-2-nitro-5-piperidin-1-ylaniline Traditional Name: (4-tert-butylbenzyl)-(2-nitro-5-piperidino-phenyl)amine Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H29N3O2/c1-22(2,3)18-9-7-17(8-10-18)16-23-20-15-19(11-12-21(20)25(26)27)24-13-5-4-6-14-24/h7-12,15,23H,4-6,13-14,16H2,1-3H3