ethyl 8-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]octanoate

Systemtic Name: ethyl 8-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]octanoate Openeye Name: ethyl 8-[4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenoxy]octanoate CAS Name: 8-[4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenoxy]octanoic acid ethyl ester IUPAC Name: ethyl 8-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]octanoate Traditional Name: 8-[4-[(E)-N'-carbobenzoxyamidino]phenoxy]caprylic acid ethyl ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCOC1=CC=C(C=C1)C(=NC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)CCCCCCCOC1=CC=C(C=C1)/C(=N\C(=O)OCC2=CC=CC=C2)/N

InChI

InChI=1S/C25H32N2O5/c1-2-30-23(28)13-9-4-3-5-10-18-31-22-16-14-21(15-17-22)24(26)27-25(29)32-19-20-11-7-6-8-12-20/h6-8,11-12,14-17H,2-5,9-10,13,18-19H2,1H3,(H2,26,27,29)