methyl 2-cyano-2-[3-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)amino]quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)amino]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[(2-phenyl-2-pyrrolidin-1-yl-ethyl)amino]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[[2-phenyl-2-(1-pyrrolidinyl)ethyl]amino]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[(2-phenyl-2-pyrrolidin-1-ylethyl)amino]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[(2-phenyl-2-pyrrolidino-ethyl)amino]quinoxalin-2-yl]acetic acid methyl ester Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NCC(C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1NCC(C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C24H25N5O2/c1-31-24(30)18(15-25)22-23(28-20-12-6-5-11-19(20)27-22)26-16-21(29-13-7-8-14-29)17-9-3-2-4-10-17/h2-6,9-12,18,21H,7-8,13-14,16H2,1H3,(H,26,28)