tert-butyl [1-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonyl]piperidin-4-yl] carbonate

Systemtic Name: tert-butyl [1-[[3-(4-carbamimidoylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonyl]piperidin-4-yl] carbonate Openeye Name: tert-butyl [1-[3-(4-carbamimidoylphenyl)-2-oxo-oxazolidine-5-carbonyl]-4-piperidyl] carbonate CAS Name: carbonic acid tert-butyl [1-[[3-(4-carbamimidoylphenyl)-2-oxo-5-oxazolidinyl]-oxomethyl]-4-piperidinyl] ester IUPAC Name: tert-butyl [1-[3-(4-carbamimidoylphenyl)-2-oxo-1,3-oxazolidine-5-carbonyl]piperidin-4-yl] carbonate Traditional Name: carbonic acid [1-[3-(4-amidinophenyl)-2-keto-oxazolidine-5-carbonyl]-4-piperidyl] tert-butyl ester Formula: C21H28N4O6 MolecularWeight: 432.47022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1CCN(CC1)C(=O)C2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)OC1CCN(CC1)C(=O)C2CN(C(=O)O2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H28N4O6/c1-21(2,3)31-20(28)29-15-8-10-24(11-9-15)18(26)16-12-25(19(27)30-16)14-6-4-13(5-7-14)17(22)23/h4-7,15-16H,8-12H2,1-3H3,(H3,22,23)