(4-acetamidophenyl) 3-(1-carbamimidoylpiperidin-4-yl)propaneperoxoate

Systemtic Name: (4-acetamidophenyl) 3-(1-carbamimidoylpiperidin-4-yl)propaneperoxoate Openeye Name: (4-acetamidophenyl) 3-(1-carbamimidoyl-4-piperidyl)propaneperoxoate CAS Name: 3-(1-carbamimidoyl-4-piperidinyl)propaneperoxoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-(1-carbamimidoylpiperidin-4-yl)propaneperoxoate Traditional Name: 3-(1-amidino-4-piperidyl)peroxypropionic acid (4-acetamidophenyl) ester Formula: C17H24N4O4 MolecularWeight: 348.39686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OOC(=O)CCC2CCN(CC2)C(=N)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OOC(=O)CCC2CCN(CC2)C(=N)N

InChI

InChI=1S/C17H24N4O4/c1-12(22)20-14-3-5-15(6-4-14)24-25-16(23)7-2-13-8-10-21(11-9-13)17(18)19/h3-6,13H,2,7-11H2,1H3,(H3,18,19)(H,20,22)