butan-1-amine; 1-(3-methylbutyl)-3-nitro-benzene

Systemtic Name: butan-1-amine; 1-(3-methylbutyl)-3-nitro-benzene Openeye Name: butan-1-amine; 1-isopentyl-3-nitro-benzene CAS Name: 1-butanamine; 1-(3-methylbutyl)-3-nitrobenzene IUPAC Name: butan-1-amine; 1-(3-methylbutyl)-3-nitrobenzene Traditional Name: butylamine; 1-isoamyl-3-nitro-benzene Formula: C15H26N2O2 MolecularWeight: 266.37914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.CC(C)CCC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCN.CC(C)CCC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H15NO2.C4H11N/c1-9(2)6-7-10-4-3-5-11(8-10)12(13)14;1-2-3-4-5/h3-5,8-9H,6-7H2,1-2H3;2-5H2,1H3