diethyl (5-oxidanylidene-4-propyl-3H-1,4-benzodiazepin-2-yl) phosphate

Systemtic Name: diethyl (5-oxidanylidene-4-propyl-3H-1,4-benzodiazepin-2-yl) phosphate Openeye Name: diethyl (5-oxo-4-propyl-3H-1,4-benzodiazepin-2-yl) phosphate CAS Name: phosphoric acid diethyl (5-oxo-4-propyl-3H-1,4-benzodiazepin-2-yl) ester IUPAC Name: diethyl (5-oxo-4-propyl-3H-1,4-benzodiazepin-2-yl) phosphate Traditional Name: phosphoric acid diethyl (5-keto-4-propyl-3H-1,4-benzodiazepin-2-yl) ester Formula: C16H23N2O5P MolecularWeight: 354.337981

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(=NC2=CC=CC=C2C1=O)OP(=O)(OCC)OCC

Isomeric SMILES

CCCN1CC(=NC2=CC=CC=C2C1=O)OP(=O)(OCC)OCC

InChI

InChI=1S/C16H23N2O5P/c1-4-11-18-12-15(23-24(20,21-5-2)22-6-3)17-14-10-8-7-9-13(14)16(18)19/h7-10H,4-6,11-12H2,1-3H3