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

Systemtic Name: [(1S)-1-(3-nitrophenyl)butyl]-propan-2-yl-azanium Openeye Name: isopropyl-[(1S)-1-(3-nitrophenyl)butyl]ammonium CAS Name: [(1S)-1-(3-nitrophenyl)butyl]-propan-2-ylammonium IUPAC Name: [(1S)-1-(3-nitrophenyl)butyl]-propan-2-ylazanium Traditional Name: isopropyl-[(1S)-1-(3-nitrophenyl)butyl]ammonium Formula: C13H21N2O2+ MolecularWeight: 237.31804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O2/c1-4-6-13(14-10(2)3)11-7-5-8-12(9-11)15(16)17/h5,7-10,13-14H,4,6H2,1-3H3/p+1/t13-/m0/s1