2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-azanium

Systemtic Name: 2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-azanium Openeye Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-ammonium CAS Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethylammonium IUPAC Name: 2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethylazanium Traditional Name: 2-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-trimethyl-ammonium Formula: C20H23ClN3O+ MolecularWeight: 356.86912

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C[N+](C)(C)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H23ClN3O/c1-24(2,3)12-11-23-18-10-9-16(21)13-17(18)20(22-14-19(23)25)15-7-5-4-6-8-15/h4-10,13H,11-12,14H2,1-3H3/q+1