[2-oxidanylidene-2-(spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylamino)ethyl] 4-methylpentanoate

Systemtic Name: [2-oxidanylidene-2-(spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylamino)ethyl] 4-methylpentanoate Openeye Name: [2-oxo-2-(spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylamino)ethyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-oxo-2-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylamino)ethyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-keto-2-(spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylamino)ethyl] ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OCC(=O)NC1=CC2=C(C=C1)OC3(O2)CCCCC3

Isomeric SMILES

CC(C)CCC(=O)OCC(=O)NC1=CC2=C(C=C1)OC3(O2)CCCCC3

InChI

InChI=1S/C20H27NO5/c1-14(2)6-9-19(23)24-13-18(22)21-15-7-8-16-17(12-15)26-20(25-16)10-4-3-5-11-20/h7-8,12,14H,3-6,9-11,13H2,1-2H3,(H,21,22)