2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]propanoic acid

Systemtic Name: 2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]propanoic acid Openeye Name: 2-[4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenyl]propanoic acid CAS Name: 2-[4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenyl]propanoic acid IUPAC Name: 2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]propanoic acid Traditional Name: 2-[4-[(E)-N'-carbobenzoxyamidino]phenyl]propionic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4/c1-12(17(21)22)14-7-9-15(10-8-14)16(19)20-18(23)24-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,22)(H2,19,20,23)