2-[5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-ethanoyl-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-1-ethanoyl-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[1-acetyl-5-[[4-(4-carbamimidoylphenyl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[1-acetyl-5-[[4-(4-amidinophenyl)phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(C1=O)CC(=O)O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(=O)N1C(CC(C1=O)CC(=O)O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H23N3O5/c1-13(26)25-18(10-17(22(25)29)11-20(27)28)12-30-19-8-6-15(7-9-19)14-2-4-16(5-3-14)21(23)24/h2-9,17-18H,10-12H2,1H3,(H3,23,24)(H,27,28)