ethanedioic acid; N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]-4-(propan-2-ylamino)-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: ethanedioic acid; N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]-4-(propan-2-ylamino)-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: 4-(isopropylamino)-N-[1-(tetrahydrofuran-2-ylmethyl)-4-piperidyl]-2,3-dihydrobenzofuran-7-carboxamide; oxalic acid CAS Name: oxalic acid; N-[1-(2-oxolanylmethyl)-4-piperidinyl]-4-(propan-2-ylamino)-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: oxalic acid; N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]-4-(propan-2-ylamino)-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: 4-(isopropylamino)-N-[1-(tetrahydrofurfuryl)-4-piperidyl]coumaran-7-carboxamide; oxalic acid Formula: C24H35N3O7 MolecularWeight: 477.5506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C2CCOC2=C(C=C1)C(=O)NC3CCN(CC3)CC4CCCO4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NC1=C2CCOC2=C(C=C1)C(=O)NC3CCN(CC3)CC4CCCO4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H33N3O3.C2H2O4/c1-15(2)23-20-6-5-19(21-18(20)9-13-28-21)22(26)24-16-7-10-25(11-8-16)14-17-4-3-12-27-17;3-1(4)2(5)6/h5-6,15-17,23H,3-4,7-14H2,1-2H3,(H,24,26);(H,3,4)(H,5,6)