ethyl 3-(5-carbamimidoyl-1-benzofuran-2-yl)-3-(4-pyrrolidin-3-yloxyphenyl)propanoate

Systemtic Name: ethyl 3-(5-carbamimidoyl-1-benzofuran-2-yl)-3-(4-pyrrolidin-3-yloxyphenyl)propanoate Openeye Name: ethyl 3-(5-carbamimidoylbenzofuran-2-yl)-3-(4-pyrrolidin-3-yloxyphenyl)propanoate CAS Name: 3-(5-carbamimidoyl-2-benzofuranyl)-3-[4-(3-pyrrolidinyloxy)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(5-carbamimidoyl-1-benzofuran-2-yl)-3-(4-pyrrolidin-3-yloxyphenyl)propanoate Traditional Name: 3-(5-amidinobenzofuran-2-yl)-3-(4-pyrrolidin-3-yloxyphenyl)propionic acid ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)OC2CCNC2)C3=CC4=C(O3)C=CC(=C4)C(=N)N

Isomeric SMILES

CCOC(=O)CC(C1=CC=C(C=C1)OC2CCNC2)C3=CC4=C(O3)C=CC(=C4)C(=N)N

InChI

InChI=1S/C24H27N3O4/c1-2-29-23(28)13-20(15-3-6-18(7-4-15)30-19-9-10-27-14-19)22-12-17-11-16(24(25)26)5-8-21(17)31-22/h3-8,11-12,19-20,27H,2,9-10,13-14H2,1H3,(H3,25,26)