(4S)-3,6,6-trimethyl-4-oxidanyl-N-(pyridin-3-ylmethyl)-5,7-dihydro-4H-1-benzofuran-2-carboxamide

Systemtic Name: (4S)-3,6,6-trimethyl-4-oxidanyl-N-(pyridin-3-ylmethyl)-5,7-dihydro-4H-1-benzofuran-2-carboxamide Openeye Name: (4S)-4-hydroxy-3,6,6-trimethyl-N-(3-pyridylmethyl)-5,7-dihydro-4H-benzofuran-2-carboxamide CAS Name: (4S)-4-hydroxy-3,6,6-trimethyl-N-(3-pyridinylmethyl)-5,7-dihydro-4H-benzofuran-2-carboxamide IUPAC Name: (4S)-4-hydroxy-3,6,6-trimethyl-N-(pyridin-3-ylmethyl)-5,7-dihydro-4H-1-benzofuran-2-carboxamide Traditional Name: (4S)-4-hydroxy-3,6,6-trimethyl-N-(3-pyridylmethyl)-5,7-dihydro-4H-benzofuran-2-carboxamide Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(CC(C2)(C)C)O)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=C(OC2=C1[C@H](CC(C2)(C)C)O)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C18H22N2O3/c1-11-15-13(21)7-18(2,3)8-14(15)23-16(11)17(22)20-10-12-5-4-6-19-9-12/h4-6,9,13,21H,7-8,10H2,1-3H3,(H,20,22)/t13-/m0/s1