7-chloranyl-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one

Systemtic Name: 7-chloranyl-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one Openeye Name: 7-chloro-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one CAS Name: 7-chloro-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one IUPAC Name: 7-chloro-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one Traditional Name: 7-chloro-1,1-dimethyl-5-phenyl-3H-1,4-benzodiazepin-1-ium-2-one Formula: C17H16ClN2O+ MolecularWeight: 299.77474

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)C

Isomeric SMILES

C[N+]1(C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)C

InChI

InChI=1S/C17H16ClN2O/c1-20(2)15-9-8-13(18)10-14(15)17(19-11-16(20)21)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3/q+1