hexyl-[(1R)-1-(3-nitrophenyl)butyl]azanium

Systemtic Name: hexyl-[(1R)-1-(3-nitrophenyl)butyl]azanium Openeye Name: hexyl-[(1R)-1-(3-nitrophenyl)butyl]ammonium CAS Name: hexyl-[(1R)-1-(3-nitrophenyl)butyl]ammonium IUPAC Name: hexyl-[(1R)-1-(3-nitrophenyl)butyl]azanium Traditional Name: hexyl-[(1R)-1-(3-nitrophenyl)butyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2/c1-3-5-6-7-12-17-16(9-4-2)14-10-8-11-15(13-14)18(19)20/h8,10-11,13,16-17H,3-7,9,12H2,1-2H3/p+1/t16-/m1/s1