[(2S)-2-[bis(2-methylpropyl)amino]-2-(2-nitrophenyl)ethyl]azanium

Systemtic Name: [(2S)-2-[bis(2-methylpropyl)amino]-2-(2-nitrophenyl)ethyl]azanium Openeye Name: [(2S)-2-(diisobutylamino)-2-(2-nitrophenyl)ethyl]ammonium CAS Name: [(2S)-2-[bis(2-methylpropyl)amino]-2-(2-nitrophenyl)ethyl]ammonium IUPAC Name: [(2S)-2-[bis(2-methylpropyl)amino]-2-(2-nitrophenyl)ethyl]azanium Traditional Name: [(2S)-2-(diisobutylamino)-2-(2-nitrophenyl)ethyl]ammonium Formula: C16H28N3O2+ MolecularWeight: 294.41242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(C[NH3+])C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(CC(C)C)[C@H](C[NH3+])C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C16H27N3O2/c1-12(2)10-18(11-13(3)4)16(9-17)14-7-5-6-8-15(14)19(20)21/h5-8,12-13,16H,9-11,17H2,1-4H3/p+1/t16-/m1/s1