(E)-but-2-enedioic acid; 1-(3-chlorophenyl)-2-phenyl-propan-2-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(3-chlorophenyl)-2-phenyl-propan-2-amine Openeye Name: 1-(3-chlorophenyl)-2-phenyl-propan-2-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(3-chlorophenyl)-2-phenyl-2-propanamine IUPAC Name: (E)-but-2-enedioic acid; 1-(3-chlorophenyl)-2-phenylpropan-2-amine Traditional Name: [2-(3-chlorophenyl)-1-methyl-1-phenyl-ethyl]amine; fumaric acid Formula: C19H20ClNO4 MolecularWeight: 361.8194

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)Cl)(C2=CC=CC=C2)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC(=CC=C1)Cl)(C2=CC=CC=C2)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H16ClN.C4H4O4/c1-15(17,13-7-3-2-4-8-13)11-12-6-5-9-14(16)10-12;5-3(6)1-2-4(7)8/h2-10H,11,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+