(Z)-but-2-enedioate; 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine

Systemtic Name: (Z)-but-2-enedioate; 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine Openeye Name: (Z)-but-2-enedioate; 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine CAS Name: (Z)-2-butenedioate; 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]pyridine IUPAC Name: (Z)-but-2-enedioate; 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine Traditional Name: 3-ethynyl-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine maleate Formula: C16H16N2O4-2 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C2=CN=CC(=C2)C#C.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN1CCC[C@H]1C2=CN=CC(=C2)C#C.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C12H14N2.C4H4O4/c1-3-10-7-11(9-13-8-10)12-5-4-6-14(12)2;5-3(6)1-2-4(7)8/h1,7-9,12H,4-6H2,2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-/t12-;/m0./s1