3-methyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-methyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1-benzofuran-2-carboxylic acid Openeye Name: 4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-benzofuran-2-carboxylic acid CAS Name: 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-methyl-2-benzofurancarboxylic acid IUPAC Name: 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-3-methyl-1-benzofuran-2-carboxylic acid Traditional Name: 4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-coumarilic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCC(CNC(C)C)O)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCC(CNC(C)C)O)C(=O)O

InChI

InChI=1S/C16H21NO5/c1-9(2)17-7-11(18)8-21-12-5-4-6-13-14(12)10(3)15(22-13)16(19)20/h4-6,9,11,17-18H,7-8H2,1-3H3,(H,19,20)