(E)-but-2-enedioate; N-(1-methylpyrrolidin-3-yl)-N-phenyl-ethanamide

Systemtic Name: (E)-but-2-enedioate; N-(1-methylpyrrolidin-3-yl)-N-phenyl-ethanamide Openeye Name: (E)-but-2-enedioate; N-(1-methylpyrrolidin-3-yl)-N-phenyl-acetamide CAS Name: (E)-2-butenedioate; N-(1-methyl-3-pyrrolidinyl)-N-phenylacetamide IUPAC Name: (E)-but-2-enedioate; N-(1-methylpyrrolidin-3-yl)-N-phenylacetamide Traditional Name: N-(1-methylpyrrolidin-3-yl)-N-phenyl-acetamide fumarate Formula: C17H20N2O5-2 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1CCN(C1)C)C2=CC=CC=C2.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(=O)N(C1CCN(C1)C)C2=CC=CC=C2.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C13H18N2O.C4H4O4/c1-11(16)15(12-6-4-3-5-7-12)13-8-9-14(2)10-13;5-3(6)1-2-4(7)8/h3-7,13H,8-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+