N-[(4-methyl-3-nitro-phenyl)methyl]-1-propan-2-yl-piperidin-4-amine

Systemtic Name: N-[(4-methyl-3-nitro-phenyl)methyl]-1-propan-2-yl-piperidin-4-amine Openeye Name: 1-isopropyl-N-[(4-methyl-3-nitro-phenyl)methyl]piperidin-4-amine CAS Name: N-[(4-methyl-3-nitrophenyl)methyl]-1-propan-2-yl-4-piperidinamine IUPAC Name: N-[(4-methyl-3-nitrophenyl)methyl]-1-propan-2-ylpiperidin-4-amine Traditional Name: (1-isopropyl-4-piperidyl)-(4-methyl-3-nitro-benzyl)amine Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2CCN(CC2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2CCN(CC2)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O2/c1-12(2)18-8-6-15(7-9-18)17-11-14-5-4-13(3)16(10-14)19(20)21/h4-5,10,12,15,17H,6-9,11H2,1-3H3