[1-[2-[(4-carbamimidoylphenyl)carbonyl-(2-methoxyethyl)amino]ethanoyl]piperidin-4-yl] ethaneperoxoate

Systemtic Name: [1-[2-[(4-carbamimidoylphenyl)carbonyl-(2-methoxyethyl)amino]ethanoyl]piperidin-4-yl] ethaneperoxoate Openeye Name: [1-[2-[(4-carbamimidoylbenzoyl)-(2-methoxyethyl)amino]acetyl]-4-piperidyl] peroxyacetate CAS Name: ethaneperoxoic acid [1-[2-[[(4-carbamimidoylphenyl)-oxomethyl]-(2-methoxyethyl)amino]-1-oxoethyl]-4-piperidinyl] ester IUPAC Name: [1-[2-[(4-carbamimidoylbenzoyl)-(2-methoxyethyl)amino]acetyl]piperidin-4-yl] ethaneperoxoate Traditional Name: peracetic acid [1-[2-[(4-amidinobenzoyl)-(2-methoxyethyl)amino]acetyl]-4-piperidyl] ester Formula: C20H28N4O6 MolecularWeight: 420.45952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOC1CCN(CC1)C(=O)CN(CCOC)C(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(=O)OOC1CCN(CC1)C(=O)CN(CCOC)C(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H28N4O6/c1-14(25)29-30-17-7-9-23(10-8-17)18(26)13-24(11-12-28-2)20(27)16-5-3-15(4-6-16)19(21)22/h3-6,17H,7-13H2,1-2H3,(H3,21,22)