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

Systemtic Name: 3-[4-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]piperidin-1-yl]propanoic acid Openeye Name: 3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]-1-piperidyl]propanoic acid CAS Name: 3-[4-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-1-piperidinyl]propanoic acid IUPAC Name: 3-[4-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]piperidin-1-yl]propanoic acid Traditional Name: 3-[4-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]piperidino]propionic acid Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CCC(=O)O

Isomeric SMILES

C1CN(CCC1N2CCN(C2=O)C3=CC=C(C=C3)C(=N)N)CCC(=O)O

InChI

InChI=1S/C18H25N5O3/c19-17(20)13-1-3-14(4-2-13)22-11-12-23(18(22)26)15-5-8-21(9-6-15)10-7-16(24)25/h1-4,15H,5-12H2,(H3,19,20)(H,24,25)