(2R)-2-(azepan-1-ium-1-yl)-N-(2-nitrophenyl)propanamide

Systemtic Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2-nitrophenyl)propanamide Openeye Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2-nitrophenyl)propanamide CAS Name: (2R)-2-(1-azepan-1-iumyl)-N-(2-nitrophenyl)propanamide IUPAC Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2-nitrophenyl)propanamide Traditional Name: (2R)-2-(azepan-1-ium-1-yl)-N-(2-nitrophenyl)propionamide Formula: C15H22N3O3+ MolecularWeight: 292.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+]2CCCCCC2

InChI

InChI=1S/C15H21N3O3/c1-12(17-10-6-2-3-7-11-17)15(19)16-13-8-4-5-9-14(13)18(20)21/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,16,19)/p+1/t12-/m1/s1