6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one

Systemtic Name: 6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one Openeye Name: 6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one CAS Name: 6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one IUPAC Name: 6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one Traditional Name: 6-phenyl-3,4-dihydro-2H-2,5-benzodiazocin-5-ium-1-one Formula: C16H15N2O+ MolecularWeight: 251.3031

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(C2=CC=CC=C2C(=O)N1)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+]=C(C2=CC=CC=C2C(=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O/c19-16-14-9-5-4-8-13(14)15(17-10-11-18-16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,18,19)/p+1