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

Systemtic Name: [7-(dimethylaminodiazenyl)-4-methyl-5-oxidanylidene-3H-1,4-benzodiazepin-2-yl] diethyl phosphate Openeye Name: [7-(dimethylaminoazo)-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl] diethyl phosphate CAS Name: phosphoric acid [7-(dimethylaminoazo)-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl] diethyl ester IUPAC Name: [7-(dimethylaminodiazenyl)-4-methyl-5-oxo-3H-1,4-benzodiazepin-2-yl] diethyl phosphate Traditional Name: phosphoric acid [7-(dimethylaminoazo)-5-keto-4-methyl-3H-1,4-benzodiazepin-2-yl] diethyl ester Formula: C16H24N5O5P MolecularWeight: 397.366021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N5O5P/c1-6-24-27(23,25-7-2)26-15-11-21(5)16(22)13-10-12(18-19-20(3)4)8-9-14(13)17-15/h8-10H,6-7,11H2,1-5H3