(3-bromophenyl)methyl 1-(4-butylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3-bromophenyl)methyl 1-(4-butylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3-bromophenyl)methyl 1-(4-butylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-butylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 1-(4-butylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-butylphenyl)-5-keto-pyrrolidine-3-carboxylic acid (3-bromobenzyl) ester Formula: C22H24BrNO3 MolecularWeight: 430.33486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC3=CC(=CC=C3)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H24BrNO3/c1-2-3-5-16-8-10-20(11-9-16)24-14-18(13-21(24)25)22(26)27-15-17-6-4-7-19(23)12-17/h4,6-12,18H,2-3,5,13-15H2,1H3