2-[1-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]methyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]methyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]methyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[[5-(4-carbamimidoylphenyl)-2-pyrimidinyl]methyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[[5-(4-carbamimidoylphenyl)pyrimidin-2-yl]methyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[[5-(4-amidinophenyl)pyrimidin-2-yl]methyl]-4-piperidyl]acetic acid Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)O)CC2=NC=C(C=N2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1CC(=O)O)CC2=NC=C(C=N2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H23N5O2/c20-19(21)15-3-1-14(2-4-15)16-10-22-17(23-11-16)12-24-7-5-13(6-8-24)9-18(25)26/h1-4,10-11,13H,5-9,12H2,(H3,20,21)(H,25,26)