3-butyl-4-[3-(tert-butylamino)propoxy]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-butyl-4-[3-(tert-butylamino)propoxy]-1-benzofuran-2-carboxylic acid Openeye Name: 3-butyl-4-[3-(tert-butylamino)propoxy]benzofuran-2-carboxylic acid CAS Name: 3-butyl-4-[3-(tert-butylamino)propoxy]-2-benzofurancarboxylic acid IUPAC Name: 3-butyl-4-[3-(tert-butylamino)propoxy]-1-benzofuran-2-carboxylic acid Traditional Name: 3-butyl-4-[3-(tert-butylamino)propoxy]coumarilic acid Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=C1C(=CC=C2)OCCCNC(C)(C)C)C(=O)O

Isomeric SMILES

CCCCC1=C(OC2=C1C(=CC=C2)OCCCNC(C)(C)C)C(=O)O

InChI

InChI=1S/C20H29NO4/c1-5-6-9-14-17-15(24-13-8-12-21-20(2,3)4)10-7-11-16(17)25-18(14)19(22)23/h7,10-11,21H,5-6,8-9,12-13H2,1-4H3,(H,22,23)