ethyl (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl]ethanoate

Systemtic Name: ethyl (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: ethyl (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl]acetate CAS Name: (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)-1-piperazinyl]-2-quinoxalinyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl]acetate Traditional Name: (2S)-2-cyano-2-[3-[4-(2-hydroxyethyl)piperazino]quinoxalin-2-yl]acetic acid ethyl ester Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H](C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)CCO

InChI

InChI=1S/C19H23N5O3/c1-2-27-19(26)14(13-20)17-18(22-16-6-4-3-5-15(16)21-17)24-9-7-23(8-10-24)11-12-25/h3-6,14,25H,2,7-12H2,1H3/t14-/m1/s1