(E)-but-2-enedioic acid; 1-(6-chloranylpyrazin-2-yl)-4-methyl-piperidin-4-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(6-chloranylpyrazin-2-yl)-4-methyl-piperidin-4-amine Openeye Name: 1-(6-chloropyrazin-2-yl)-4-methyl-piperidin-4-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(6-chloro-2-pyrazinyl)-4-methyl-4-piperidinamine IUPAC Name: (E)-but-2-enedioic acid; 1-(6-chloropyrazin-2-yl)-4-methylpiperidin-4-amine Traditional Name: [1-(6-chloropyrazin-2-yl)-4-methyl-4-piperidyl]amine; fumaric acid Formula: C14H19ClN4O4 MolecularWeight: 342.77806

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C2=CN=CC(=N2)Cl)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1(CCN(CC1)C2=CN=CC(=N2)Cl)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H15ClN4.C4H4O4/c1-10(12)2-4-15(5-3-10)9-7-13-6-8(11)14-9;5-3(6)1-2-4(7)8/h6-7H,2-5,12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+