(phenylmethyl) N-[2,4-bis(oxidanylidene)-1-(3-oxidanylpropyl)pyrimidin-5-yl]carbonylcarbamate

Systemtic Name: (phenylmethyl) N-[2,4-bis(oxidanylidene)-1-(3-oxidanylpropyl)pyrimidin-5-yl]carbonylcarbamate Openeye Name: benzyl N-[1-(3-hydroxypropyl)-2,4-dioxo-pyrimidine-5-carbonyl]carbamate CAS Name: N-[[1-(3-hydroxypropyl)-2,4-dioxo-5-pyrimidinyl]-oxomethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(3-hydroxypropyl)-2,4-dioxopyrimidine-5-carbonyl]carbamate Traditional Name: N-[1-(3-hydroxypropyl)-2,4-diketo-pyrimidine-5-carbonyl]carbamic acid benzyl ester Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(=O)C2=CN(C(=O)NC2=O)CCCO

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(=O)C2=CN(C(=O)NC2=O)CCCO

InChI

InChI=1S/C16H17N3O6/c20-8-4-7-19-9-12(13(21)17-15(19)23)14(22)18-16(24)25-10-11-5-2-1-3-6-11/h1-3,5-6,9,20H,4,7-8,10H2,(H,17,21,23)(H,18,22,24)