2-(2-methylpropanoylamino)ethyl-[(1R)-1-(3-nitrophenyl)ethyl]azanium

Systemtic Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(3-nitrophenyl)ethyl]azanium Openeye Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(3-nitrophenyl)ethyl]ammonium CAS Name: 2-[(2-methyl-1-oxopropyl)amino]ethyl-[(1R)-1-(3-nitrophenyl)ethyl]ammonium IUPAC Name: 2-(2-methylpropanoylamino)ethyl-[(1R)-1-(3-nitrophenyl)ethyl]azanium Traditional Name: 2-(isobutyrylamino)ethyl-[(1R)-1-(3-nitrophenyl)ethyl]ammonium Formula: C14H22N3O3+ MolecularWeight: 280.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c1-10(2)14(18)16-8-7-15-11(3)12-5-4-6-13(9-12)17(19)20/h4-6,9-11,15H,7-8H2,1-3H3,(H,16,18)/p+1/t11-/m1/s1