3-[6-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pyridin-3-yl]propanoic acid

Systemtic Name: 3-[6-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]pyridin-3-yl]propanoic acid Openeye Name: 3-[6-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]-3-pyridyl]propanoic acid CAS Name: 3-[6-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-3-pyridinyl]propanoic acid IUPAC Name: 3-[6-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]pyridin-3-yl]propanoic acid Traditional Name: 3-[6-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]-3-pyridyl]propionic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1C2=CC=C(C=C2)C(=N)N)C3=NC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1CN(C(=O)N1C2=CC=C(C=C2)C(=N)N)C3=NC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C18H19N5O3/c19-17(20)13-3-5-14(6-4-13)22-9-10-23(18(22)26)15-7-1-12(11-21-15)2-8-16(24)25/h1,3-7,11H,2,8-10H2,(H3,19,20)(H,24,25)