dimethyl-[(2R)-4-methyl-1-[[(1R)-1-(2-nitrophenyl)ethyl]amino]pentan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-4-methyl-1-[[(1R)-1-(2-nitrophenyl)ethyl]amino]pentan-2-yl]azanium Openeye Name: dimethyl-[(1R)-3-methyl-1-[[[(1R)-1-(2-nitrophenyl)ethyl]amino]methyl]butyl]ammonium CAS Name: dimethyl-[(2R)-4-methyl-1-[[(1R)-1-(2-nitrophenyl)ethyl]amino]pentan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-4-methyl-1-[[(1R)-1-(2-nitrophenyl)ethyl]amino]pentan-2-yl]azanium Traditional Name: dimethyl-[(1R)-3-methyl-1-[[[(1R)-1-(2-nitrophenyl)ethyl]amino]methyl]butyl]ammonium Formula: C16H28N3O2+ MolecularWeight: 294.41242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC=CC=C1[N+](=O)[O-])NC[C@@H](CC(C)C)[NH+](C)C

InChI

InChI=1S/C16H27N3O2/c1-12(2)10-14(18(4)5)11-17-13(3)15-8-6-7-9-16(15)19(20)21/h6-9,12-14,17H,10-11H2,1-5H3/p+1/t13-,14-/m1/s1