[3-[(dipropylamino)methyl]-2,3-dihydro-1-benzofuran-5-yl] N-propan-2-ylcarbamate; ethanedioic acid

Systemtic Name: [3-[(dipropylamino)methyl]-2,3-dihydro-1-benzofuran-5-yl] N-propan-2-ylcarbamate; ethanedioic acid Openeye Name: [3-[(dipropylamino)methyl]-2,3-dihydrobenzofuran-5-yl] N-isopropylcarbamate; oxalic acid CAS Name: oxalic acid; N-propan-2-ylcarbamic acid [3-[(dipropylamino)methyl]-2,3-dihydrobenzofuran-5-yl] ester IUPAC Name: [3-[(dipropylamino)methyl]-2,3-dihydro-1-benzofuran-5-yl] N-propan-2-ylcarbamate; oxalic acid Traditional Name: N-isopropylcarbamic acid [3-[(dipropylamino)methyl]coumaran-5-yl] ester; oxalic acid Formula: C21H32N2O7 MolecularWeight: 424.48798

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1COC2=C1C=C(C=C2)OC(=O)NC(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN(CCC)CC1COC2=C1C=C(C=C2)OC(=O)NC(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H30N2O3.C2H2O4/c1-5-9-21(10-6-2)12-15-13-23-18-8-7-16(11-17(15)18)24-19(22)20-14(3)4;3-1(4)2(5)6/h7-8,11,14-15H,5-6,9-10,12-13H2,1-4H3,(H,20,22);(H,3,4)(H,5,6)