2-[[4-(3-carbamimidoylphenoxy)pyrrolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[[4-(3-carbamimidoylphenoxy)pyrrolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 2-[[4-(3-carbamimidoylphenoxy)pyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: 2-[[[4-(3-carbamimidoylphenoxy)-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[4-(3-carbamimidoylphenoxy)pyrrolidine-2-carbonyl]amino]propanoic acid Traditional Name: 2-[[4-(3-amidinophenoxy)prolyl]amino]propionic acid Formula: C15H20N4O4 MolecularWeight: 320.3437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1CC(CN1)OC2=CC=CC(=C2)C(=N)N

Isomeric SMILES

CC(C(=O)O)NC(=O)C1CC(CN1)OC2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C15H20N4O4/c1-8(15(21)22)19-14(20)12-6-11(7-18-12)23-10-4-2-3-9(5-10)13(16)17/h2-5,8,11-12,18H,6-7H2,1H3,(H3,16,17)(H,19,20)(H,21,22)