2-cyanoethyl 3,3-dimethyl-2-oxidanylidene-5-propanoyl-indole-1-carboxylate

Systemtic Name: 2-cyanoethyl 3,3-dimethyl-2-oxidanylidene-5-propanoyl-indole-1-carboxylate Openeye Name: 2-cyanoethyl 3,3-dimethyl-2-oxo-5-propanoyl-indoline-1-carboxylate CAS Name: 3,3-dimethyl-2-oxo-5-(1-oxopropyl)-1-indolecarboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 3,3-dimethyl-2-oxo-5-propanoylindole-1-carboxylate Traditional Name: 2-keto-3,3-dimethyl-5-propionyl-indoline-1-carboxylic acid 2-cyanoethyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)N(C(=O)C2(C)C)C(=O)OCCC#N

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)N(C(=O)C2(C)C)C(=O)OCCC#N

InChI

InChI=1S/C17H18N2O4/c1-4-14(20)11-6-7-13-12(10-11)17(2,3)15(21)19(13)16(22)23-9-5-8-18/h6-7,10H,4-5,9H2,1-3H3