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

Systemtic Name: [7-chloranyl-5-oxidanylidene-4-(phenylmethyl)-3H-1,4-benzodiazepin-2-yl] diethyl phosphate Openeye Name: (4-benzyl-7-chloro-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate CAS Name: phosphoric acid [7-chloro-5-oxo-4-(phenylmethyl)-3H-1,4-benzodiazepin-2-yl] diethyl ester IUPAC Name: (4-benzyl-7-chloro-5-oxo-3H-1,4-benzodiazepin-2-yl) diethyl phosphate Traditional Name: phosphoric acid (4-benzyl-7-chloro-5-keto-3H-1,4-benzodiazepin-2-yl) diethyl ester Formula: C20H22ClN2O5P MolecularWeight: 436.825841

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=NC2=C(C=C(C=C2)Cl)C(=O)N(C1)CC3=CC=CC=C3

Isomeric SMILES

CCOP(=O)(OCC)OC1=NC2=C(C=C(C=C2)Cl)C(=O)N(C1)CC3=CC=CC=C3

InChI

InChI=1S/C20H22ClN2O5P/c1-3-26-29(25,27-4-2)28-19-14-23(13-15-8-6-5-7-9-15)20(24)17-12-16(21)10-11-18(17)22-19/h5-12H,3-4,13-14H2,1-2H3