2-[4-carbamimidoyl-2-[3-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]carbonyloxypropoxy]phenoxy]ethanoic acid

Systemtic Name: 2-[4-carbamimidoyl-2-[3-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]carbonyloxypropoxy]phenoxy]ethanoic acid Openeye Name: 2-[4-carbamimidoyl-2-[3-[4-(pyrrolidine-1-carboximidoyl)benzoyl]oxypropoxy]phenoxy]acetic acid CAS Name: 2-[4-carbamimidoyl-2-[3-[[4-[imino(1-pyrrolidinyl)methyl]phenyl]-oxomethoxy]propoxy]phenoxy]acetic acid IUPAC Name: 2-[4-carbamimidoyl-2-[3-[4-(pyrrolidine-1-carboximidoyl)benzoyl]oxypropoxy]phenoxy]acetic acid Traditional Name: 2-[4-amidino-2-[3-[4-(pyrrolidine-1-carboximidoyl)benzoyl]oxypropoxy]phenoxy]acetic acid Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=N)C2=CC=C(C=C2)C(=O)OCCCOC3=C(C=CC(=C3)C(=N)N)OCC(=O)O

Isomeric SMILES

C1CCN(C1)C(=N)C2=CC=C(C=C2)C(=O)OCCCOC3=C(C=CC(=C3)C(=N)N)OCC(=O)O

InChI

InChI=1S/C24H28N4O6/c25-22(26)18-8-9-19(34-15-21(29)30)20(14-18)32-12-3-13-33-24(31)17-6-4-16(5-7-17)23(27)28-10-1-2-11-28/h4-9,14,27H,1-3,10-13,15H2,(H3,25,26)(H,29,30)