methyl 3-[5-[4-(4-carbamimidoylphenyl)phenyl]furan-2-yl]propanoate

Systemtic Name: methyl 3-[5-[4-(4-carbamimidoylphenyl)phenyl]furan-2-yl]propanoate Openeye Name: methyl 3-[5-[4-(4-carbamimidoylphenyl)phenyl]-2-furyl]propanoate CAS Name: 3-[5-[4-(4-carbamimidoylphenyl)phenyl]-2-furanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-[4-(4-carbamimidoylphenyl)phenyl]furan-2-yl]propanoate Traditional Name: 3-[5-[4-(4-amidinophenyl)phenyl]-2-furyl]propionic acid methyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(O1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CC=C(O1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H20N2O3/c1-25-20(24)13-11-18-10-12-19(26-18)16-6-2-14(3-7-16)15-4-8-17(9-5-15)21(22)23/h2-10,12H,11,13H2,1H3,(H3,22,23)