diethyl [5-oxidanylidene-4-(phenylmethyl)-3H-1,4-benzodiazepin-2-yl] phosphate

Systemtic Name: diethyl [5-oxidanylidene-4-(phenylmethyl)-3H-1,4-benzodiazepin-2-yl] phosphate Openeye Name: (4-benzyl-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate CAS Name: phosphoric acid diethyl [5-oxo-4-(phenylmethyl)-3H-1,4-benzodiazepin-2-yl] ester IUPAC Name: (4-benzyl-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate Traditional Name: phosphoric acid (4-benzyl-5-keto-3H-1,4-benzodiazepin-2-yl) diethyl ester Formula: C20H23N2O5P MolecularWeight: 402.380781

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=NC2=CC=CC=C2C(=O)N(C1)CC3=CC=CC=C3

Isomeric SMILES

CCOP(=O)(OCC)OC1=NC2=CC=CC=C2C(=O)N(C1)CC3=CC=CC=C3

InChI

InChI=1S/C20H23N2O5P/c1-3-25-28(24,26-4-2)27-19-15-22(14-16-10-6-5-7-11-16)20(23)17-12-8-9-13-18(17)21-19/h5-13H,3-4,14-15H2,1-2H3