[2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-cyclopentylpropanoate

Systemtic Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 3-cyclopentylpropanoate Openeye Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxo-ethyl] 3-cyclopentylpropanoate CAS Name: 3-cyclopentylpropanoic acid [2-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxoethyl] 3-cyclopentylpropanoate Traditional Name: 3-cyclopentylpropionic acid [2-[4-(isovalerylamino)phenyl]-2-keto-ethyl] ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCC2CCCC2

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCC2CCCC2

InChI

InChI=1S/C21H29NO4/c1-15(2)13-20(24)22-18-10-8-17(9-11-18)19(23)14-26-21(25)12-7-16-5-3-4-6-16/h8-11,15-16H,3-7,12-14H2,1-2H3,(H,22,24)