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

Systemtic Name: 2-butyl-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1,3-benzoxazole-5-carboxamide Openeye Name: 2-butyl-N-(isochroman-1-ylmethyl)-1,3-benzoxazole-5-carboxamide CAS Name: 2-butyl-N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-butyl-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1,3-benzoxazole-5-carboxamide Traditional Name: 2-butyl-N-(isochroman-1-ylmethyl)-1,3-benzoxazole-5-carboxamide Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(O1)C=CC(=C2)C(=O)NCC3C4=CC=CC=C4CCO3

Isomeric SMILES

CCCCC1=NC2=C(O1)C=CC(=C2)C(=O)NCC3C4=CC=CC=C4CCO3

InChI

InChI=1S/C22H24N2O3/c1-2-3-8-21-24-18-13-16(9-10-19(18)27-21)22(25)23-14-20-17-7-5-4-6-15(17)11-12-26-20/h4-7,9-10,13,20H,2-3,8,11-12,14H2,1H3,(H,23,25)