3-(aminocarbonylamino)-2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]propanoic acid

Systemtic Name: 3-(aminocarbonylamino)-2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]propanoic acid Openeye Name: 2-[1-(4-carbamimidoylphenyl)-2-oxo-pyrrolidin-3-yl]-3-ureido-propanoic acid CAS Name: 2-[1-(4-carbamimidoylphenyl)-2-oxo-3-pyrrolidinyl]-3-(carbamoylamino)propanoic acid IUPAC Name: 2-[1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]-3-(carbamoylamino)propanoic acid Traditional Name: 2-[1-(4-amidinophenyl)-2-keto-pyrrolidin-3-yl]-3-ureido-propionic acid Formula: C15H19N5O4 MolecularWeight: 333.34246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C(CNC(=O)N)C(=O)O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(C(=O)C1C(CNC(=O)N)C(=O)O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C15H19N5O4/c16-12(17)8-1-3-9(4-2-8)20-6-5-10(13(20)21)11(14(22)23)7-19-15(18)24/h1-4,10-11H,5-7H2,(H3,16,17)(H,22,23)(H3,18,19,24)