(7-bromanyl-4-methyl-5-oxidanylidene-3H-1,4-benzodiazepin-2-yl) diethyl phosphate

Systemtic Name: (7-bromanyl-4-methyl-5-oxidanylidene-3H-1,4-benzodiazepin-2-yl) diethyl phosphate Openeye Name: (7-bromo-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate CAS Name: phosphoric acid (7-bromo-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl ester IUPAC Name: (7-bromo-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate Traditional Name: phosphoric acid (7-bromo-5-keto-4-methyl-3H-1,4-benzodiazepin-2-yl) diethyl ester Formula: C14H18BrN2O5P MolecularWeight: 405.180881

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=NC2=C(C=C(C=C2)Br)C(=O)N(C1)C

Isomeric SMILES

CCOP(=O)(OCC)OC1=NC2=C(C=C(C=C2)Br)C(=O)N(C1)C

InChI

InChI=1S/C14H18BrN2O5P/c1-4-20-23(19,21-5-2)22-13-9-17(3)14(18)11-8-10(15)6-7-12(11)16-13/h6-8H,4-5,9H2,1-3H3