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5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoic acid

5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoic acid

Systemtic Name:5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoic acid
Openeye Name:5-[4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenoxy]pentanoic acid
CAS Name:5-[4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenoxy]pentanoic acid
IUPAC Name:5-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenoxy]pentanoic acid
Traditional Name:5-[4-[(E)-N'-carbobenzoxyamidino]phenoxy]valeric acid
Formula: C20H22N2O5
MolecularWeight: 370.39908
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N=C(C2=CC=C(C=C2)OCCCCC(=O)O)N


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/N=C(\C2=CC=C(C=C2)OCCCCC(=O)O)/N


InChI

InChI=1S/C20H22N2O5/c21-19(22-20(25)27-14-15-6-2-1-3-7-15)16-9-11-17(12-10-16)26-13-5-4-8-18(23)24/h1-3,6-7,9-12H,4-5,8,13-14H2,(H,23,24)(H2,21,22,25)


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