[1-(3-ethoxy-3-oxidanylidene-propyl)piperidin-4-yl] 5-carbamimidoyl-1-benzofuran-2-carboxylate

Systemtic Name: [1-(3-ethoxy-3-oxidanylidene-propyl)piperidin-4-yl] 5-carbamimidoyl-1-benzofuran-2-carboxylate Openeye Name: [1-(3-ethoxy-3-oxo-propyl)-4-piperidyl] 5-carbamimidoylbenzofuran-2-carboxylate CAS Name: 5-carbamimidoyl-2-benzofurancarboxylic acid [1-(3-ethoxy-3-oxopropyl)-4-piperidinyl] ester IUPAC Name: [1-(3-ethoxy-3-oxopropyl)piperidin-4-yl] 5-carbamimidoyl-1-benzofuran-2-carboxylate Traditional Name: 5-amidinocoumarilic acid [1-(3-ethoxy-3-keto-propyl)-4-piperidyl] ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCC(CC1)OC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CCN1CCC(CC1)OC(=O)C2=CC3=C(O2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C20H25N3O5/c1-2-26-18(24)7-10-23-8-5-15(6-9-23)27-20(25)17-12-14-11-13(19(21)22)3-4-16(14)28-17/h3-4,11-12,15H,2,5-10H2,1H3,(H3,21,22)