O4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxo-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-[1-(2-cyanoethyl)-3-indolyl]-2-oxoethyl] ester O2-ethyl ester IUPAC Name: 4-O-[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxoethyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-[1-(2-cyanoethyl)indol-3-yl]-2-keto-ethyl] ester O2-ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)C2=CN(C3=CC=CC=C32)CCC#N)C

InChI

InChI=1S/C23H23N3O5/c1-4-30-23(29)21-14(2)20(15(3)25-21)22(28)31-13-19(27)17-12-26(11-7-10-24)18-9-6-5-8-16(17)18/h5-6,8-9,12,25H,4,7,11,13H2,1-3H3