N-[(4-butylphenyl)methyl]-1-(3-nitrophenyl)pentan-1-amine

Systemtic Name: N-[(4-butylphenyl)methyl]-1-(3-nitrophenyl)pentan-1-amine Openeye Name: N-[(4-butylphenyl)methyl]-1-(3-nitrophenyl)pentan-1-amine CAS Name: N-[(4-butylphenyl)methyl]-1-(3-nitrophenyl)-1-pentanamine IUPAC Name: N-[(4-butylphenyl)methyl]-1-(3-nitrophenyl)pentan-1-amine Traditional Name: (4-butylbenzyl)-[1-(3-nitrophenyl)pentyl]amine Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CNC(CCCC)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)CNC(CCCC)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H30N2O2/c1-3-5-8-18-12-14-19(15-13-18)17-23-22(11-6-4-2)20-9-7-10-21(16-20)24(25)26/h7,9-10,12-16,22-23H,3-6,8,11,17H2,1-2H3