5-[4-(3-azanylpropoxy)-3-[(piperidin-4-ylmethylamino)methyl]phenyl]-N-methyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-[4-(3-azanylpropoxy)-3-[(piperidin-4-ylmethylamino)methyl]phenyl]-N-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-[4-(3-aminopropoxy)-3-[(4-piperidylmethylamino)methyl]phenyl]-N-methyl-benzofuran-2-carboxamide CAS Name: 5-[4-(3-aminopropoxy)-3-[(4-piperidinylmethylamino)methyl]phenyl]-N-methyl-2-benzofurancarboxamide IUPAC Name: 5-[4-(3-aminopropoxy)-3-[(piperidin-4-ylmethylamino)methyl]phenyl]-N-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-[4-(3-aminopropoxy)-3-[(4-piperidylmethylamino)methyl]phenyl]-N-methyl-coumarilamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC2=C(O1)C=CC(=C2)C3=CC(=C(C=C3)OCCCN)CNCC4CCNCC4

Isomeric SMILES

CNC(=O)C1=CC2=C(O1)C=CC(=C2)C3=CC(=C(C=C3)OCCCN)CNCC4CCNCC4

InChI

InChI=1S/C26H34N4O3/c1-28-26(31)25-15-21-13-19(4-6-24(21)33-25)20-3-5-23(32-12-2-9-27)22(14-20)17-30-16-18-7-10-29-11-8-18/h3-6,13-15,18,29-30H,2,7-12,16-17,27H2,1H3,(H,28,31)