ethyl 5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoate

Systemtic Name: ethyl 5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoate Openeye Name: ethyl 5-[4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenoxy]pentanoate CAS Name: 5-[4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoate Traditional Name: 5-[4-[(E)-N'-carbobenzoxyamidino]phenoxy]valeric acid ethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCOC1=CC=C(C=C1)C(=NC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)CCCCOC1=CC=C(C=C1)/C(=N\C(=O)OCC2=CC=CC=C2)/N

InChI

InChI=1S/C22H26N2O5/c1-2-27-20(25)10-6-7-15-28-19-13-11-18(12-14-19)21(23)24-22(26)29-16-17-8-4-3-5-9-17/h3-5,8-9,11-14H,2,6-7,10,15-16H2,1H3,(H2,23,24,26)