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

Systemtic Name: 3-methyl-4-[3-(piperidin-4-ylamino)propoxy]-1-benzofuran-2-carboxylic acid Openeye Name: 3-methyl-4-[3-(4-piperidylamino)propoxy]benzofuran-2-carboxylic acid CAS Name: 3-methyl-4-[3-(4-piperidinylamino)propoxy]-2-benzofurancarboxylic acid IUPAC Name: 3-methyl-4-[3-(piperidin-4-ylamino)propoxy]-1-benzofuran-2-carboxylic acid Traditional Name: 3-methyl-4-[3-(4-piperidylamino)propoxy]coumarilic acid Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCCCNC3CCNCC3)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCCCNC3CCNCC3)C(=O)O

InChI

InChI=1S/C18H24N2O4/c1-12-16-14(4-2-5-15(16)24-17(12)18(21)22)23-11-3-8-20-13-6-9-19-10-7-13/h2,4-5,13,19-20H,3,6-11H2,1H3,(H,21,22)