N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperidin-3-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperidin-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]-3-piperidyl]triazole-4-carboxamide CAS Name: N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-6-benzofuranyl)methyl]-3-piperidinyl]-4-triazolecarboxamide IUPAC Name: N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-1-benzofuran-6-yl)methyl]piperidin-3-yl]triazole-4-carboxamide Traditional Name: N-(2-hydroxyethyl)-1-[1-[(5-methoxy-2-methyl-3-phenyl-benzofuran-6-yl)methyl]-3-piperidyl]triazole-4-carboxamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)CN3CCCC(C3)N4C=C(N=N4)C(=O)NCCO)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)CN3CCCC(C3)N4C=C(N=N4)C(=O)NCCO)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O4/c1-18-26(19-7-4-3-5-8-19)22-14-24(35-2)20(13-25(22)36-18)15-31-11-6-9-21(16-31)32-17-23(29-30-32)27(34)28-10-12-33/h3-5,7-8,13-14,17,21,33H,6,9-12,15-16H2,1-2H3,(H,28,34)