N-[(4-nitrophenyl)methyl]pentan-3-amine

Systemtic Name: N-[(4-nitrophenyl)methyl]pentan-3-amine Openeye Name: N-[(4-nitrophenyl)methyl]pentan-3-amine CAS Name: N-[(4-nitrophenyl)methyl]-3-pentanamine IUPAC Name: N-[(4-nitrophenyl)methyl]pentan-3-amine Traditional Name: 1-ethylpropyl-(4-nitrobenzyl)amine Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O2/c1-3-11(4-2)13-9-10-5-7-12(8-6-10)14(15)16/h5-8,11,13H,3-4,9H2,1-2H3