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

Systemtic Name: ethyl 5-(3-cyano-2-oxidanylidene-propoxy)-2-methyl-1-(2-methylphenyl)indole-3-carboxylate Openeye Name: ethyl 5-(3-cyano-2-oxo-propoxy)-2-methyl-1-(o-tolyl)indole-3-carboxylate CAS Name: 5-(3-cyano-2-oxopropoxy)-2-methyl-1-(2-methylphenyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-cyano-2-oxopropoxy)-2-methyl-1-(2-methylphenyl)indole-3-carboxylate Traditional Name: 5-(3-cyano-2-keto-propoxy)-2-methyl-1-(o-tolyl)indole-3-carboxylic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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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=C3C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)CC#N)C3=CC=CC=C3C)C

InChI

InChI=1S/C23H22N2O4/c1-4-28-23(27)22-16(3)25(20-8-6-5-7-15(20)2)21-10-9-18(13-19(21)22)29-14-17(26)11-12-24/h5-10,13H,4,11,14H2,1-3H3