[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 4-methyl-2-oxidanyl-benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 4-methyl-2-oxidanyl-benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-hydroxy-4-methyl-benzoate CAS Name: 2-hydroxy-4-methylbenzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-hydroxy-4-methylbenzoate Traditional Name: 2-hydroxy-4-methyl-benzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4/c1-10(2)6-7-16-14(18)9-20-15(19)12-5-4-11(3)8-13(12)17/h4-5,8,10,17H,6-7,9H2,1-3H3,(H,16,18)