2-[1-[4-(5-carbamimidoylpyrimidin-2-yl)phenyl]carbonylpiperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(5-carbamimidoylpyrimidin-2-yl)phenyl]carbonylpiperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(5-carbamimidoylpyrimidin-2-yl)benzoyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[[4-(5-carbamimidoyl-2-pyrimidinyl)phenyl]-oxomethyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[4-(5-carbamimidoylpyrimidin-2-yl)benzoyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[4-(5-amidinopyrimidin-2-yl)benzoyl]-4-piperidyl]acetic acid Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)O)C(=O)C2=CC=C(C=C2)C3=NC=C(C=N3)C(=N)N

Isomeric SMILES

C1CN(CCC1CC(=O)O)C(=O)C2=CC=C(C=C2)C3=NC=C(C=N3)C(=N)N

InChI

InChI=1S/C19H21N5O3/c20-17(21)15-10-22-18(23-11-15)13-1-3-14(4-2-13)19(27)24-7-5-12(6-8-24)9-16(25)26/h1-4,10-12H,5-9H2,(H3,20,21)(H,25,26)