ethanedioic acid; 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-thiophen-3-yl-propan-1-ol

Systemtic Name: ethanedioic acid; 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-thiophen-3-yl-propan-1-ol Openeye Name: 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-(3-thienyl)propan-1-ol; oxalic acid CAS Name: 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-(3-thiophenyl)-1-propanol; oxalic acid IUPAC Name: 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-thiophen-3-ylpropan-1-ol; oxalic acid Traditional Name: 3-[2-[4-(2-ethoxyethoxy)phenyl]ethylamino]-2-(3-thienyl)propan-1-ol; oxalic acid Formula: C21H29NO7S MolecularWeight: 439.52246

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=C(C=C1)CCNCC(CO)C2=CSC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCOCCOC1=CC=C(C=C1)CCNCC(CO)C2=CSC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27NO3S.C2H2O4/c1-2-22-10-11-23-19-5-3-16(4-6-19)7-9-20-13-18(14-21)17-8-12-24-15-17;3-1(4)2(5)6/h3-6,8,12,15,18,20-21H,2,7,9-11,13-14H2,1H3;(H,3,4)(H,5,6)