N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Openeye Name: N-(isochroman-1-ylmethyl)-2-isopropyl-1,3-benzoxazole-5-carboxamide CAS Name: N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide IUPAC Name: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Traditional Name: N-(isochroman-1-ylmethyl)-2-isopropyl-1,3-benzoxazole-5-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC3C4=CC=CC=C4CCO3

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC3C4=CC=CC=C4CCO3

InChI

InChI=1S/C21H22N2O3/c1-13(2)21-23-17-11-15(7-8-18(17)26-21)20(24)22-12-19-16-6-4-3-5-14(16)9-10-25-19/h3-8,11,13,19H,9-10,12H2,1-2H3,(H,22,24)