methyl 2-cyano-2-[3-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(4-veratroylpiperazino)quinoxalin-2-yl]acetic acid methyl ester Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OC)OC

InChI

InChI=1S/C25H25N5O5/c1-33-20-9-8-16(14-21(20)34-2)24(31)30-12-10-29(11-13-30)23-22(17(15-26)25(32)35-3)27-18-6-4-5-7-19(18)28-23/h4-9,14,17H,10-13H2,1-3H3