(E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-1-phenyl-propan-2-amine

Systemtic Name: (E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-1-phenyl-propan-2-amine Openeye Name: fumaric acid; N-(1-methyl-2-phenoxy-ethyl)-1-phenyl-propan-2-amine CAS Name: (E)-2-butenedioic acid; N-(1-phenoxypropan-2-yl)-1-phenyl-2-propanamine IUPAC Name: (E)-but-2-enedioic acid; N-(1-phenoxypropan-2-yl)-1-phenylpropan-2-amine Traditional Name: fumaric acid; (1-methyl-2-phenoxy-ethyl)-(1-methyl-2-phenyl-ethyl)amine Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NC(C)COC2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)NC(C)COC2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C18H23NO.C4H4O4/c1-15(13-17-9-5-3-6-10-17)19-16(2)14-20-18-11-7-4-8-12-18;5-3(6)1-2-4(7)8/h3-12,15-16,19H,13-14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+