butan-2-yl 4-(2-bromophenyl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: butan-2-yl 4-(2-bromophenyl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: sec-butyl 4-(2-bromophenyl)-2-methylene-6-oxo-piperidine-3-carboxylate CAS Name: 4-(2-bromophenyl)-2-methylene-6-oxo-3-piperidinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-(2-bromophenyl)-2-methylidene-6-oxopiperidine-3-carboxylate Traditional Name: 4-(2-bromophenyl)-6-keto-2-methylene-nipecotic acid sec-butyl ester Formula: C17H20BrNO3 MolecularWeight: 366.2496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1C(CC(=O)NC1=C)C2=CC=CC=C2Br

Isomeric SMILES

CCC(C)OC(=O)C1C(CC(=O)NC1=C)C2=CC=CC=C2Br

InChI

InChI=1S/C17H20BrNO3/c1-4-10(2)22-17(21)16-11(3)19-15(20)9-13(16)12-7-5-6-8-14(12)18/h5-8,10,13,16H,3-4,9H2,1-2H3,(H,19,20)