(2-methyl-1-oxidanyl-propan-2-yl)-[(1S)-1-(3-nitrophenyl)butyl]azanium

Systemtic Name: (2-methyl-1-oxidanyl-propan-2-yl)-[(1S)-1-(3-nitrophenyl)butyl]azanium Openeye Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1S)-1-(3-nitrophenyl)butyl]ammonium CAS Name: (1-hydroxy-2-methylpropan-2-yl)-[(1S)-1-(3-nitrophenyl)butyl]ammonium IUPAC Name: (1-hydroxy-2-methylpropan-2-yl)-[(1S)-1-(3-nitrophenyl)butyl]azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1S)-1-(3-nitrophenyl)butyl]ammonium Formula: C14H23N2O3+ MolecularWeight: 267.34402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3/c1-4-6-13(15-14(2,3)10-17)11-7-5-8-12(9-11)16(18)19/h5,7-9,13,15,17H,4,6,10H2,1-3H3/p+1/t13-/m0/s1