ethyl 3-[4-[(E)-2-methylbut-2-enoyl]piperazin-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-[(E)-2-methylbut-2-enoyl]piperazin-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-[(E)-2-methylbut-2-enoyl]piperazin-1-yl]quinoxaline-2-carboxylate CAS Name: 3-[4-[(E)-2-methyl-1-oxobut-2-enyl]-1-piperazinyl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-[(E)-2-methylbut-2-enoyl]piperazin-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-[(E)-2-methylbut-2-enoyl]piperazino]quinoxaline-2-carboxylic acid ethyl ester Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(=O)C(=CC)C

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(=O)/C(=C/C)/C

InChI

InChI=1S/C20H24N4O3/c1-4-14(3)19(25)24-12-10-23(11-13-24)18-17(20(26)27-5-2)21-15-8-6-7-9-16(15)22-18/h4,6-9H,5,10-13H2,1-3H3/b14-4+