[oxidanylidene-(7-phenylazepan-3-yl)azaniumyl]methanoate

Systemtic Name: [oxidanylidene-(7-phenylazepan-3-yl)azaniumyl]methanoate Openeye Name: [oxo-(7-phenylazepan-3-yl)ammonio]formate CAS Name: [oxo-(7-phenyl-3-azepanyl)ammonio]formate IUPAC Name: [oxo-(7-phenylazepan-3-yl)azaniumyl]formate Traditional Name: [keto-(7-phenylazepan-3-yl)ammonio]formate Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC(C1)C2=CC=CC=C2)[N+](=O)C(=O)[O-]

Isomeric SMILES

C1CC(CNC(C1)C2=CC=CC=C2)[N+](=O)C(=O)[O-]

InChI

InChI=1S/C13H16N2O3/c16-13(17)15(18)11-7-4-8-12(14-9-11)10-5-2-1-3-6-10/h1-3,5-6,11-12,14H,4,7-9H2