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

Systemtic Name: 4-azanyl-N-[(1-butyl-3-oxidanyl-piperidin-4-yl)methyl]-5-chloranyl-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: 4-amino-N-[(1-butyl-3-hydroxy-4-piperidyl)methyl]-5-chloro-2,3-dihydrobenzofuran-7-carboxamide CAS Name: 4-amino-N-[(1-butyl-3-hydroxy-4-piperidinyl)methyl]-5-chloro-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: 4-amino-N-[(1-butyl-3-hydroxypiperidin-4-yl)methyl]-5-chloro-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: 4-amino-N-[(1-butyl-3-hydroxy-4-piperidyl)methyl]-5-chloro-coumaran-7-carboxamide Formula: C19H28ClN3O3 MolecularWeight: 381.89692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(C(C1)O)CNC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

Isomeric SMILES

CCCCN1CCC(C(C1)O)CNC(=O)C2=CC(=C(C3=C2OCC3)N)Cl

InChI

InChI=1S/C19H28ClN3O3/c1-2-3-6-23-7-4-12(16(24)11-23)10-22-19(25)14-9-15(20)17(21)13-5-8-26-18(13)14/h9,12,16,24H,2-8,10-11,21H2,1H3,(H,22,25)