1-methyl-4-oxidanidyl-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one

Systemtic Name: 1-methyl-4-oxidanidyl-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one Openeye Name: 1-methyl-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one CAS Name: 1-methyl-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one IUPAC Name: 1-methyl-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one Traditional Name: 1-methyl-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-one Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C[N+](=C(C2=CC=CC=C21)C3=CC=CC=C3)[O-]

Isomeric SMILES

CN1C(=O)C[N+](=C(C2=CC=CC=C21)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C16H14N2O2/c1-17-14-10-6-5-9-13(14)16(18(20)11-15(17)19)12-7-3-2-4-8-12/h2-10H,11H2,1H3