1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol; ethanedioic acid Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(tetrahydrofuran-2-ylmethoxy)propan-2-ol; oxalic acid CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(2-oxolanylmethoxy)-2-propanol; oxalic acid IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol; oxalic acid Traditional Name: 1-(homoveratrylamino)-3-(tetrahydrofurfuryloxy)propan-2-ol; oxalic acid Formula: C20H31NO9 MolecularWeight: 429.46144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COCC2CCCO2)O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COCC2CCCO2)O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H29NO5.C2H2O4/c1-21-17-6-5-14(10-18(17)22-2)7-8-19-11-15(20)12-23-13-16-4-3-9-24-16;3-1(4)2(5)6/h5-6,10,15-16,19-20H,3-4,7-9,11-13H2,1-2H3;(H,3,4)(H,5,6)