[2-[[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate

Systemtic Name: [2-[[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate Openeye Name: [2-[[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-oxo-ethyl] 2-(8-quinolyl)acetate CAS Name: 2-(8-quinolinyl)acetic acid [2-[[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]amino]-2-oxoethyl] 2-quinolin-8-ylacetate Traditional Name: 2-(8-quinolyl)acetic acid [2-[[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]amino]-2-keto-ethyl] ester Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)COC(=O)CC2=CC=CC3=C2N=CC=C3)CC4=CC=CO4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)COC(=O)CC2=CC=CC3=C2N=CC=C3)CC4=CC=CO4)C

InChI

InChI=1S/C25H22N4O4/c1-16-17(2)29(14-20-9-5-11-32-20)25(21(16)13-26)28-22(30)15-33-23(31)12-19-7-3-6-18-8-4-10-27-24(18)19/h3-11H,12,14-15H2,1-2H3,(H,28,30)