[2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxidanylidene-1-phenyl-ethyl] 2-propylpentanoate

Systemtic Name: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxidanylidene-1-phenyl-ethyl] 2-propylpentanoate Openeye Name: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenyl-ethyl] 2-propylpentanoate CAS Name: 2-propylpentanoic acid [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-2-oxo-1-phenylethyl] 2-propylpentanoate Traditional Name: 2-propylvaleric acid [2-keto-2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-1-phenyl-ethyl] ester Formula: C24H35NO4 MolecularWeight: 401.539

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)OC(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C

Isomeric SMILES

CCCC(CCC)C(=O)OC(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C

InChI

InChI=1S/C24H35NO4/c1-4-9-18(10-5-2)23(26)29-22(17-11-7-6-8-12-17)24(27)28-21-15-19-13-14-20(16-21)25(19)3/h6-8,11-12,18-22H,4-5,9-10,13-16H2,1-3H3