N-(2-methylpropyl)-1-(3-nitrophenyl)butan-1-amine

Systemtic Name: N-(2-methylpropyl)-1-(3-nitrophenyl)butan-1-amine Openeye Name: N-isobutyl-1-(3-nitrophenyl)butan-1-amine CAS Name: N-(2-methylpropyl)-1-(3-nitrophenyl)-1-butanamine IUPAC Name: N-(2-methylpropyl)-1-(3-nitrophenyl)butan-1-amine Traditional Name: isobutyl-[1-(3-nitrophenyl)butyl]amine Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCC(C)C

Isomeric SMILES

CCCC(C1=CC(=CC=C1)[N+](=O)[O-])NCC(C)C

InChI

InChI=1S/C14H22N2O2/c1-4-6-14(15-10-11(2)3)12-7-5-8-13(9-12)16(17)18/h5,7-9,11,14-15H,4,6,10H2,1-3H3