ethanedioic acid; 3-[2-(methylamino)ethyl]cyclohex-3-en-1-one

Systemtic Name: ethanedioic acid; 3-[2-(methylamino)ethyl]cyclohex-3-en-1-one Openeye Name: 3-[2-(methylamino)ethyl]cyclohex-3-en-1-one; oxalic acid CAS Name: 3-[2-(methylamino)ethyl]-1-cyclohex-3-enone; oxalic acid IUPAC Name: 3-[2-(methylamino)ethyl]cyclohex-3-en-1-one; oxalic acid Traditional Name: 3-[2-(methylamino)ethyl]cyclohex-3-en-1-one; oxalic acid Formula: C11H17NO5 MolecularWeight: 243.25638

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC1=CCCC(=O)C1.C(=O)(C(=O)O)O

Isomeric SMILES

CNCCC1=CCCC(=O)C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H15NO.C2H2O4/c1-10-6-5-8-3-2-4-9(11)7-8;3-1(4)2(5)6/h3,10H,2,4-7H2,1H3;(H,3,4)(H,5,6)