methyl 3-[1-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]piperidin-4-yl]propanoate

Systemtic Name: methyl 3-[1-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]piperidin-4-yl]propanoate Openeye Name: methyl 3-[1-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-4-piperidyl]propanoate CAS Name: 3-[1-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]-4-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[5-(4-carbamimidoylphenyl)-1H-imidazol-2-yl]piperidin-4-yl]propanoate Traditional Name: 3-[1-[5-(4-amidinophenyl)-1H-imidazol-2-yl]-4-piperidyl]propionic acid methyl ester Formula: C19H25N5O2 MolecularWeight: 355.4341

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1CCN(CC1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1CCN(CC1)C2=NC=C(N2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H25N5O2/c1-26-17(25)7-2-13-8-10-24(11-9-13)19-22-12-16(23-19)14-3-5-15(6-4-14)18(20)21/h3-6,12-13H,2,7-11H2,1H3,(H3,20,21)(H,22,23)