ethyl 5-(3-cyano-2-oxidanylidene-propoxy)-2-methyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 5-(3-cyano-2-oxidanylidene-propoxy)-2-methyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 5-(3-cyano-2-oxo-propoxy)-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-(3-cyano-2-oxopropoxy)-2-methyl-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-cyano-2-oxopropoxy)-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-(3-cyano-2-keto-propoxy)-2-methyl-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)CC#N)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)CC#N)C3=CC=CC=C3)C

InChI

InChI=1S/C22H20N2O4/c1-3-27-22(26)21-15(2)24(16-7-5-4-6-8-16)20-10-9-18(13-19(20)21)28-14-17(25)11-12-23/h4-10,13H,3,11,14H2,1-2H3