5-(tert-butylamino)-4-propoxy-3-propyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-(tert-butylamino)-4-propoxy-3-propyl-1-benzofuran-2-carboxylic acid Openeye Name: 5-(tert-butylamino)-4-propoxy-3-propyl-benzofuran-2-carboxylic acid CAS Name: 5-(tert-butylamino)-4-propoxy-3-propyl-2-benzofurancarboxylic acid IUPAC Name: 5-(tert-butylamino)-4-propoxy-3-propyl-1-benzofuran-2-carboxylic acid Traditional Name: 5-(tert-butylamino)-4-propoxy-3-propyl-coumarilic acid Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C1C(=C(C=C2)NC(C)(C)C)OCCC)C(=O)O

Isomeric SMILES

CCCC1=C(OC2=C1C(=C(C=C2)NC(C)(C)C)OCCC)C(=O)O

InChI

InChI=1S/C19H27NO4/c1-6-8-12-15-14(24-16(12)18(21)22)10-9-13(20-19(3,4)5)17(15)23-11-7-2/h9-10,20H,6-8,11H2,1-5H3,(H,21,22)