[2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 4-(6-carbamimidoyl-1-benzofuran-2-yl)-2-pyrrolidin-1-yl-butanoate

Systemtic Name: [2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 4-(6-carbamimidoyl-1-benzofuran-2-yl)-2-pyrrolidin-1-yl-butanoate Openeye Name: [2-(oxomethylene)pyrrolidin-1-yl] 4-(6-carbamimidoylbenzofuran-2-yl)-2-pyrrolidin-1-yl-butanoate CAS Name: 4-(6-carbamimidoyl-2-benzofuranyl)-2-(1-pyrrolidinyl)butanoic acid [2-(oxomethylidene)-1-pyrrolidinyl] ester IUPAC Name: [2-(oxomethylidene)pyrrolidin-1-yl] 4-(6-carbamimidoyl-1-benzofuran-2-yl)-2-pyrrolidin-1-ylbutanoate Traditional Name: 4-(6-amidinobenzofuran-2-yl)-2-pyrrolidino-butyric acid [2-(ketomethylene)pyrrolidino] ester Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CCC2=CC3=C(O2)C=C(C=C3)C(=N)N)C(=O)ON4CCCC4=C=O

Isomeric SMILES

C1CCN(C1)C(CCC2=CC3=C(O2)C=C(C=C3)C(=N)N)C(=O)ON4CCCC4=C=O

InChI

InChI=1S/C22H26N4O4/c23-21(24)16-6-5-15-12-18(29-20(15)13-16)7-8-19(25-9-1-2-10-25)22(28)30-26-11-3-4-17(26)14-27/h5-6,12-13,19H,1-4,7-11H2,(H3,23,24)