dimethyl 2-(3-piperidin-1-ylquinoxalin-2-yl)propanedioate

Systemtic Name: dimethyl 2-(3-piperidin-1-ylquinoxalin-2-yl)propanedioate Openeye Name: dimethyl 2-[3-(1-piperidyl)quinoxalin-2-yl]propanedioate CAS Name: 2-[3-(1-piperidinyl)-2-quinoxalinyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3-piperidin-1-ylquinoxalin-2-yl)propanedioate Traditional Name: 2-(3-piperidinoquinoxalin-2-yl)malonic acid dimethyl ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=NC2=CC=CC=C2N=C1N3CCCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=NC2=CC=CC=C2N=C1N3CCCCC3)C(=O)OC

InChI

InChI=1S/C18H21N3O4/c1-24-17(22)14(18(23)25-2)15-16(21-10-6-3-7-11-21)20-13-9-5-4-8-12(13)19-15/h4-5,8-9,14H,3,6-7,10-11H2,1-2H3