(7R)-7-phenyl-1,4-diazepan-1-ium-5-one

Systemtic Name: (7R)-7-phenyl-1,4-diazepan-1-ium-5-one Openeye Name: (7R)-7-phenyl-1,4-diazepan-1-ium-5-one CAS Name: (7R)-7-phenyl-1,4-diazepan-1-ium-5-one IUPAC Name: (7R)-7-phenyl-1,4-diazepan-1-ium-5-one Traditional Name: (7R)-7-phenyl-1,4-diazepan-1-ium-5-one Formula: C11H15N2O+ MolecularWeight: 191.2496

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)CC([NH2+]1)C2=CC=CC=C2

Isomeric SMILES

C1CNC(=O)C[C@@H]([NH2+]1)C2=CC=CC=C2

InChI

InChI=1S/C11H14N2O/c14-11-8-10(12-6-7-13-11)9-4-2-1-3-5-9/h1-5,10,12H,6-8H2,(H,13,14)/p+1/t10-/m1/s1