(2-piperidin-1-ylcyclopentyl) (E)-2-[(4-bromophenyl)methoxy]-3-oxidanylidene-hept-4-enoate

Systemtic Name: (2-piperidin-1-ylcyclopentyl) (E)-2-[(4-bromophenyl)methoxy]-3-oxidanylidene-hept-4-enoate Openeye Name: [2-(1-piperidyl)cyclopentyl] (E)-2-[(4-bromophenyl)methoxy]-3-oxo-hept-4-enoate CAS Name: (E)-2-[(4-bromophenyl)methoxy]-3-oxo-4-heptenoic acid [2-(1-piperidinyl)cyclopentyl] ester IUPAC Name: (2-piperidin-1-ylcyclopentyl) (E)-2-[(4-bromophenyl)methoxy]-3-oxohept-4-enoate Traditional Name: (E)-2-(4-bromobenzyl)oxy-3-keto-hept-4-enoic acid (2-piperidinocyclopentyl) ester Formula: C24H32BrNO4 MolecularWeight: 478.41918

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)C(C(=O)OC1CCCC1N2CCCCC2)OCC3=CC=C(C=C3)Br

Isomeric SMILES

CC/C=C/C(=O)C(C(=O)OC1CCCC1N2CCCCC2)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H32BrNO4/c1-2-3-9-21(27)23(29-17-18-11-13-19(25)14-12-18)24(28)30-22-10-7-8-20(22)26-15-5-4-6-16-26/h3,9,11-14,20,22-23H,2,4-8,10,15-17H2,1H3/b9-3+