3-methylbutyl-[(1R)-1-(2-nitrophenyl)ethyl]azanium

Systemtic Name: 3-methylbutyl-[(1R)-1-(2-nitrophenyl)ethyl]azanium Openeye Name: isopentyl-[(1R)-1-(2-nitrophenyl)ethyl]ammonium CAS Name: 3-methylbutyl-[(1R)-1-(2-nitrophenyl)ethyl]ammonium IUPAC Name: 3-methylbutyl-[(1R)-1-(2-nitrophenyl)ethyl]azanium Traditional Name: isoamyl-[(1R)-1-(2-nitrophenyl)ethyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]C(C)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1[N+](=O)[O-])[NH2+]CCC(C)C

InChI

InChI=1S/C13H20N2O2/c1-10(2)8-9-14-11(3)12-6-4-5-7-13(12)15(16)17/h4-7,10-11,14H,8-9H2,1-3H3/p+1/t11-/m1/s1