[1-(3-methoxypropyl)-3-oxidanyl-piperidin-4-yl]methyl 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate

Systemtic Name: [1-(3-methoxypropyl)-3-oxidanyl-piperidin-4-yl]methyl 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate Openeye Name: [3-hydroxy-1-(3-methoxypropyl)-4-piperidyl]methyl 4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylate CAS Name: 4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylic acid [3-hydroxy-1-(3-methoxypropyl)-4-piperidinyl]methyl ester IUPAC Name: [3-hydroxy-1-(3-methoxypropyl)piperidin-4-yl]methyl 4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate Traditional Name: 4-amino-5-chloro-coumaran-7-carboxylic acid [3-hydroxy-1-(3-methoxypropyl)-4-piperidyl]methyl ester Formula: C19H27ClN2O5 MolecularWeight: 398.88108

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1CCC(C(C1)O)COC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

Isomeric SMILES

COCCCN1CCC(C(C1)O)COC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

InChI

InChI=1S/C19H27ClN2O5/c1-25-7-2-5-22-6-3-12(16(23)10-22)11-27-19(24)14-9-15(20)17(21)13-4-8-26-18(13)14/h9,12,16,23H,2-8,10-11,21H2,1H3