[(2R)-2-(azepan-1-yl)-2-(4-nitrophenyl)ethyl]azanium

Systemtic Name: [(2R)-2-(azepan-1-yl)-2-(4-nitrophenyl)ethyl]azanium Openeye Name: [(2R)-2-(azepan-1-yl)-2-(4-nitrophenyl)ethyl]ammonium CAS Name: [(2R)-2-(1-azepanyl)-2-(4-nitrophenyl)ethyl]ammonium IUPAC Name: [(2R)-2-(azepan-1-yl)-2-(4-nitrophenyl)ethyl]azanium Traditional Name: [(2R)-2-(azepan-1-yl)-2-(4-nitrophenyl)ethyl]ammonium Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(C[NH3+])C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)[C@@H](C[NH3+])C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O2/c15-11-14(16-9-3-1-2-4-10-16)12-5-7-13(8-6-12)17(18)19/h5-8,14H,1-4,9-11,15H2/p+1/t14-/m0/s1