[1-[N'-(furan-3-ylmethyl)carbamimidoyl]pyrrolidin-3-yl] (2R)-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [1-[N'-(furan-3-ylmethyl)carbamimidoyl]pyrrolidin-3-yl] (2R)-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [1-[N'-(3-furylmethyl)carbamimidoyl]pyrrolidin-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetic acid [1-[amino(3-furanylmethylimino)methyl]-3-pyrrolidinyl] ester IUPAC Name: [1-[N'-(furan-3-ylmethyl)carbamimidoyl]pyrrolidin-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid [1-[N'-(3-furfuryl)amidino]pyrrolidin-3-yl] ester Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3CCN(C3)C(=NCC4=COC=C4)N)O

Isomeric SMILES

C1CCC(C1)[C@@](C2=CC=CC=C2)(C(=O)OC3CCN(C3)C(=NCC4=COC=C4)N)O

InChI

InChI=1S/C23H29N3O4/c24-22(25-14-17-11-13-29-16-17)26-12-10-20(15-26)30-21(27)23(28,19-8-4-5-9-19)18-6-2-1-3-7-18/h1-3,6-7,11,13,16,19-20,28H,4-5,8-10,12,14-15H2,(H2,24,25)/t20?,23-/m0/s1