(E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-3,3-diphenyl-propan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-3,3-diphenyl-propan-1-amine Openeye Name: fumaric acid; N-(1-methyl-2-phenoxy-ethyl)-3,3-diphenyl-propan-1-amine CAS Name: (E)-2-butenedioic acid; N-(1-phenoxypropan-2-yl)-3,3-diphenyl-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-3,3-diphenylpropan-1-amine Traditional Name: 3,3-diphenylpropyl-(1-methyl-2-phenoxy-ethyl)amine; fumaric acid Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(COC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C24H27NO.C4H4O4/c1-20(19-26-23-15-9-4-10-16-23)25-18-17-24(21-11-5-2-6-12-21)22-13-7-3-8-14-22;5-3(6)1-2-4(7)8/h2-16,20,24-25H,17-19H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+