methyl 3-[3-[4-(4-carbamimidoylphenyl)phenyl]-1H-pyrazol-5-yl]propanoate

Systemtic Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)phenyl]-1H-pyrazol-5-yl]propanoate Openeye Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)phenyl]-1H-pyrazol-5-yl]propanoate CAS Name: 3-[3-[4-(4-carbamimidoylphenyl)phenyl]-1H-pyrazol-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[4-(4-carbamimidoylphenyl)phenyl]-1H-pyrazol-5-yl]propanoate Traditional Name: 3-[3-[4-(4-amidinophenyl)phenyl]-1H-pyrazol-5-yl]propionic acid methyl ester Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=NN1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CC(=NN1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H20N4O2/c1-26-19(25)11-10-17-12-18(24-23-17)15-6-2-13(3-7-15)14-4-8-16(9-5-14)20(21)22/h2-9,12H,10-11H2,1H3,(H3,21,22)(H,23,24)