(E)-but-2-enedioic acid; N,N-diethyl-2-[4-(phenylmethyl)phenoxy]ethanamine

Systemtic Name: (E)-but-2-enedioic acid; N,N-diethyl-2-[4-(phenylmethyl)phenoxy]ethanamine Openeye Name: 2-(4-benzylphenoxy)-N,N-diethyl-ethanamine; fumaric acid CAS Name: (E)-2-butenedioic acid; N,N-diethyl-2-[4-(phenylmethyl)phenoxy]ethanamine IUPAC Name: 2-(4-benzylphenoxy)-N,N-diethylethanamine; (E)-but-2-enedioic acid Traditional Name: 2-(4-benzylphenoxy)ethyl-diethyl-amine; fumaric acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)CC2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)CC2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H25NO.C4H4O4/c1-3-20(4-2)14-15-21-19-12-10-18(11-13-19)16-17-8-6-5-7-9-17;5-3(6)1-2-4(7)8/h5-13H,3-4,14-16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+