ethyl 3-(4-bromophenyl)carbonyl-2-butyl-pyrazolo[1,5-a]pyridine-6-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)carbonyl-2-butyl-pyrazolo[1,5-a]pyridine-6-carboxylate Openeye Name: ethyl 3-(4-bromobenzoyl)-2-butyl-pyrazolo[1,5-a]pyridine-6-carboxylate CAS Name: 3-[(4-bromophenyl)-oxomethyl]-2-butyl-6-pyrazolo[1,5-a]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromobenzoyl)-2-butylpyrazolo[1,5-a]pyridine-6-carboxylate Traditional Name: 3-(4-bromobenzoyl)-2-butyl-pyrazolo[1,5-a]pyridine-6-carboxylic acid ethyl ester Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN2C=C(C=CC2=C1C(=O)C3=CC=C(C=C3)Br)C(=O)OCC

Isomeric SMILES

CCCCC1=NN2C=C(C=CC2=C1C(=O)C3=CC=C(C=C3)Br)C(=O)OCC

InChI

InChI=1S/C21H21BrN2O3/c1-3-5-6-17-19(20(25)14-7-10-16(22)11-8-14)18-12-9-15(13-24(18)23-17)21(26)27-4-2/h7-13H,3-6H2,1-2H3