[4-(4-chloranylbutyl)-5-oxidanylidene-1,4-benzoxazepin-3-yl] diethyl phosphate

Systemtic Name: [4-(4-chloranylbutyl)-5-oxidanylidene-1,4-benzoxazepin-3-yl] diethyl phosphate Openeye Name: [4-(4-chlorobutyl)-5-oxo-1,4-benzoxazepin-3-yl] diethyl phosphate CAS Name: phosphoric acid [4-(4-chlorobutyl)-5-oxo-1,4-benzoxazepin-3-yl] diethyl ester IUPAC Name: [4-(4-chlorobutyl)-5-oxo-1,4-benzoxazepin-3-yl] diethyl phosphate Traditional Name: phosphoric acid [4-(4-chlorobutyl)-5-keto-1,4-benzoxazepin-3-yl] diethyl ester Formula: C17H23ClNO6P MolecularWeight: 403.794381

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=COC2=CC=CC=C2C(=O)N1CCCCCl

Isomeric SMILES

CCOP(=O)(OCC)OC1=COC2=CC=CC=C2C(=O)N1CCCCCl

InChI

InChI=1S/C17H23ClNO6P/c1-3-23-26(21,24-4-2)25-16-13-22-15-10-6-5-9-14(15)17(20)19(16)12-8-7-11-18/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3