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

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

Systemtic Name:2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-diethyl-azanium
Openeye Name:2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-diethyl-ammonium
CAS Name:2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-diethylammonium
IUPAC Name:2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-diethylazanium
Traditional Name:2-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethyl-diethyl-ammonium
Formula: C21H25ClN3O+
MolecularWeight: 370.8957
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H24ClN3O/c1-3-24(4-2)12-13-25-19-11-10-17(22)14-18(19)21(23-15-20(25)26)16-8-6-5-7-9-16/h5-11,14H,3-4,12-13,15H2,1-2H3/p+1


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