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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2=CC=C(O2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2=CC=C(O2)C3=CC=C(C=C3)C(=N)N

InChI

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