3-[4-[1-(4-carbamimidoylphenyl)-5-oxidanylidene-3-pyrrolidin-1-yl-2H-pyrrol-4-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[1-(4-carbamimidoylphenyl)-5-oxidanylidene-3-pyrrolidin-1-yl-2H-pyrrol-4-yl]phenyl]propanoic acid Openeye Name: 3-[4-[1-(4-carbamimidoylphenyl)-5-oxo-3-pyrrolidin-1-yl-2H-pyrrol-4-yl]phenyl]propanoic acid CAS Name: 3-[4-[1-(4-carbamimidoylphenyl)-5-oxo-3-(1-pyrrolidinyl)-2H-pyrrol-4-yl]phenyl]propanoic acid IUPAC Name: 3-[4-[1-(4-carbamimidoylphenyl)-5-oxo-3-pyrrolidin-1-yl-2H-pyrrol-4-yl]phenyl]propanoic acid Traditional Name: 3-[4-[1-(4-amidinophenyl)-2-keto-4-pyrrolidino-3-pyrrolin-3-yl]phenyl]propionic acid Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)N(C2)C3=CC=C(C=C3)C(=N)N)C4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)N(C2)C3=CC=C(C=C3)C(=N)N)C4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C24H26N4O3/c25-23(26)18-8-10-19(11-9-18)28-15-20(27-13-1-2-14-27)22(24(28)31)17-6-3-16(4-7-17)5-12-21(29)30/h3-4,6-11H,1-2,5,12-15H2,(H3,25,26)(H,29,30)