2-[4-[3-(tert-butylamino)propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[4-[3-(tert-butylamino)propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[4-[3-(tert-butylamino)propoxy]-3-methyl-benzofuran-2-yl]oxazole-4-carboxylic acid CAS Name: 2-[4-[3-(tert-butylamino)propoxy]-3-methyl-2-benzofuranyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[4-[3-(tert-butylamino)propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[4-[3-(tert-butylamino)propoxy]-3-methyl-benzofuran-2-yl]oxazole-4-carboxylic acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCCCNC(C)(C)C)C3=NC(=CO3)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCCCNC(C)(C)C)C3=NC(=CO3)C(=O)O

InChI

InChI=1S/C20H24N2O5/c1-12-16-14(25-10-6-9-21-20(2,3)4)7-5-8-15(16)27-17(12)18-22-13(11-26-18)19(23)24/h5,7-8,11,21H,6,9-10H2,1-4H3,(H,23,24)