2-[5-[[4-(4-carbamimidoylphenyl)cyclohexyl]oxymethyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[4-(4-carbamimidoylphenyl)cyclohexyl]oxymethyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[[4-(4-carbamimidoylphenyl)cyclohexoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[4-(4-carbamimidoylphenyl)cyclohexyl]oxymethyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[[4-(4-carbamimidoylphenyl)cyclohexyl]oxymethyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[[4-(4-amidinophenyl)cyclohexoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=C(C=C2)C(=N)N)OCC3CC(C(=O)N3)CC(=O)O

Isomeric SMILES

C1CC(CCC1C2=CC=C(C=C2)C(=N)N)OCC3CC(C(=O)N3)CC(=O)O

InChI

InChI=1S/C20H27N3O4/c21-19(22)14-3-1-12(2-4-14)13-5-7-17(8-6-13)27-11-16-9-15(10-18(24)25)20(26)23-16/h1-4,13,15-17H,5-11H2,(H3,21,22)(H,23,26)(H,24,25)