methyl (E)-3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[5-(4-amidinophenyl)-1H-imidazol-2-yl]phenyl]acrylic acid methyl ester Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)/C=C/C1=CC=C(C=C1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H18N4O2/c1-26-18(25)11-4-13-2-5-16(6-3-13)20-23-12-17(24-20)14-7-9-15(10-8-14)19(21)22/h2-12H,1H3,(H3,21,22)(H,23,24)/b11-4+