[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2,4,6-trimethylbenzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2,4,6-trimethylbenzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)NCCC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OCC(=O)NCCC(C)C)C

InChI

InChI=1S/C17H25NO3/c1-11(2)6-7-18-15(19)10-21-17(20)16-13(4)8-12(3)9-14(16)5/h8-9,11H,6-7,10H2,1-5H3,(H,18,19)