4-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]butanoic acid

Systemtic Name: 4-[2-[3-(4-carbamimidoylphenyl)-2-oxidanylidene-imidazolidin-1-yl]ethanoylamino]butanoic acid Openeye Name: 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-imidazolidin-1-yl]acetyl]amino]butanoic acid CAS Name: 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxo-1-imidazolidinyl]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-[3-(4-carbamimidoylphenyl)-2-oxoimidazolidin-1-yl]acetyl]amino]butanoic acid Traditional Name: 4-[[2-[3-(4-amidinophenyl)-2-keto-imidazolidin-1-yl]acetyl]amino]butyric acid Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1CC(=O)NCCCC(=O)O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(C(=O)N1CC(=O)NCCCC(=O)O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C16H21N5O4/c17-15(18)11-3-5-12(6-4-11)21-9-8-20(16(21)25)10-13(22)19-7-1-2-14(23)24/h3-6H,1-2,7-10H2,(H3,17,18)(H,19,22)(H,23,24)