methyl 4-[[azanyl-(3-azanyl-2-oxidanylidene-piperidin-1-yl)phosphoryl]amino]benzoate

Systemtic Name: methyl 4-[[azanyl-(3-azanyl-2-oxidanylidene-piperidin-1-yl)phosphoryl]amino]benzoate Openeye Name: methyl 4-[[amino-(3-amino-2-oxo-1-piperidyl)phosphoryl]amino]benzoate CAS Name: 4-[[amino-(3-amino-2-oxo-1-piperidinyl)phosphoryl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[amino-(3-amino-2-oxopiperidin-1-yl)phosphoryl]amino]benzoate Traditional Name: 4-[[amino-(3-amino-2-keto-piperidino)phosphoryl]amino]benzoic acid methyl ester Formula: C13H19N4O4P MolecularWeight: 326.288121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NP(=O)(N)N2CCCC(C2=O)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NP(=O)(N)N2CCCC(C2=O)N

InChI

InChI=1S/C13H19N4O4P/c1-21-13(19)9-4-6-10(7-5-9)16-22(15,20)17-8-2-3-11(14)12(17)18/h4-7,11H,2-3,8,14H2,1H3,(H3,15,16,20)