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

Systemtic Name: [1-(3-methoxypropyl)piperidin-4-yl] 4-azanyl-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxylate Openeye Name: [1-(3-methoxypropyl)-4-piperidyl] 4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylate CAS Name: 4-amino-5-chloro-2,3-dihydrobenzofuran-7-carboxylic acid [1-(3-methoxypropyl)-4-piperidinyl] ester IUPAC Name: [1-(3-methoxypropyl)piperidin-4-yl] 4-amino-5-chloro-2,3-dihydro-1-benzofuran-7-carboxylate Traditional Name: 4-amino-5-chloro-coumaran-7-carboxylic acid [1-(3-methoxypropyl)-4-piperidyl] ester Formula: C18H25ClN2O4 MolecularWeight: 368.8551

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1CCC(CC1)OC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

Isomeric SMILES

COCCCN1CCC(CC1)OC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

InChI

InChI=1S/C18H25ClN2O4/c1-23-9-2-6-21-7-3-12(4-8-21)25-18(22)14-11-15(19)16(20)13-5-10-24-17(13)14/h11-12H,2-10,20H2,1H3