(E)-but-2-enedioate; N-[1-(dimethylamino)propan-2-yl]-N-phenyl-ethanamide

Systemtic Name: (E)-but-2-enedioate; N-[1-(dimethylamino)propan-2-yl]-N-phenyl-ethanamide Openeye Name: (E)-but-2-enedioate; N-[2-(dimethylamino)-1-methyl-ethyl]-N-phenyl-acetamide CAS Name: (E)-2-butenedioate; N-[1-(dimethylamino)propan-2-yl]-N-phenylacetamide IUPAC Name: (E)-but-2-enedioate; N-[1-(dimethylamino)propan-2-yl]-N-phenylacetamide Traditional Name: N-[2-(dimethylamino)-1-methyl-ethyl]-N-phenyl-acetamide fumarate Formula: C17H22N2O5-2 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)C)N(C1=CC=CC=C1)C(=O)C.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(CN(C)C)N(C1=CC=CC=C1)C(=O)C.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C13H20N2O.C4H4O4/c1-11(10-14(3)4)15(12(2)16)13-8-6-5-7-9-13;5-3(6)1-2-4(7)8/h5-9,11H,10H2,1-4H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+