methyl 3-[1-[4-(4-carbamimidoylphenyl)cyclohexyl]imidazol-4-yl]propanoate

Systemtic Name: methyl 3-[1-[4-(4-carbamimidoylphenyl)cyclohexyl]imidazol-4-yl]propanoate Openeye Name: methyl 3-[1-[4-(4-carbamimidoylphenyl)cyclohexyl]imidazol-4-yl]propanoate CAS Name: 3-[1-[4-(4-carbamimidoylphenyl)cyclohexyl]-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[4-(4-carbamimidoylphenyl)cyclohexyl]imidazol-4-yl]propanoate Traditional Name: 3-[1-[4-(4-amidinophenyl)cyclohexyl]imidazol-4-yl]propionic acid methyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CN(C=N1)C2CCC(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CN(C=N1)C2CCC(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H26N4O2/c1-26-19(25)11-8-17-12-24(13-23-17)18-9-6-15(7-10-18)14-2-4-16(5-3-14)20(21)22/h2-5,12-13,15,18H,6-11H2,1H3,(H3,21,22)