[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] hexaneperoxoate

Systemtic Name: [4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] hexaneperoxoate Openeye Name: [4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenyl] hexaneperoxoate CAS Name: hexaneperoxoic acid [4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenyl] ester IUPAC Name: [4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl] hexaneperoxoate Traditional Name: hexaneperoxoic acid [4-[(E)-N'-carbobenzoxyamidino]phenyl] ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OOC1=CC=C(C=C1)C(=NC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCCCCC(=O)OOC1=CC=C(C=C1)/C(=N\C(=O)OCC2=CC=CC=C2)/N

InChI

InChI=1S/C21H24N2O5/c1-2-3-5-10-19(24)28-27-18-13-11-17(12-14-18)20(22)23-21(25)26-15-16-8-6-4-7-9-16/h4,6-9,11-14H,2-3,5,10,15H2,1H3,(H2,22,23,25)