ethanedioic acid; (E)-N-methyl-4-pyridin-3-yl-but-3-en-1-amine

Systemtic Name: ethanedioic acid; (E)-N-methyl-4-pyridin-3-yl-but-3-en-1-amine Openeye Name: (E)-N-methyl-4-(3-pyridyl)but-3-en-1-amine; oxalic acid CAS Name: (E)-N-methyl-4-(3-pyridinyl)-3-buten-1-amine; oxalic acid IUPAC Name: (E)-N-methyl-4-pyridin-3-ylbut-3-en-1-amine; oxalic acid Traditional Name: methyl-[(E)-4-(3-pyridyl)but-3-enyl]amine; oxalic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC=CC1=CN=CC=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CNCC/C=C/C1=CN=CC=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C10H14N2.C2H2O4/c1-11-7-3-2-5-10-6-4-8-12-9-10;3-1(4)2(5)6/h2,4-6,8-9,11H,3,7H2,1H3;(H,3,4)(H,5,6)/b5-2+;