ethyl 3-(4-bromophenyl)carbonyl-8-cyano-indolizine-1-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)carbonyl-8-cyano-indolizine-1-carboxylate Openeye Name: ethyl 3-(4-bromobenzoyl)-8-cyano-indolizine-1-carboxylate CAS Name: 3-[(4-bromophenyl)-oxomethyl]-8-cyano-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromobenzoyl)-8-cyanoindolizine-1-carboxylate Traditional Name: 3-(4-bromobenzoyl)-8-cyano-indolizine-1-carboxylic acid ethyl ester Formula: C19H13BrN2O3 MolecularWeight: 397.22212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=CN2C(=C1)C(=O)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=CN2C(=C1)C(=O)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C19H13BrN2O3/c1-2-25-19(24)15-10-16(18(23)12-5-7-14(20)8-6-12)22-9-3-4-13(11-21)17(15)22/h3-10H,2H2,1H3