2-[4-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]ethanoate

Systemtic Name: 2-[4-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]ethanoate Openeye Name: 2-[4-[(1S)-2-(isopentylamino)-1-methyl-2-oxo-ethoxy]phenyl]acetate CAS Name: 2-[4-[(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]oxyphenyl]acetate IUPAC Name: 2-[4-[(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]oxyphenyl]acetate Traditional Name: 2-[4-[(1S)-2-(isoamylamino)-2-keto-1-methyl-ethoxy]phenyl]acetate Formula: C16H22NO4- MolecularWeight: 292.35018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)OC1=CC=C(C=C1)CC(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCCC(C)C)OC1=CC=C(C=C1)CC(=O)[O-]

InChI

InChI=1S/C16H23NO4/c1-11(2)8-9-17-16(20)12(3)21-14-6-4-13(5-7-14)10-15(18)19/h4-7,11-12H,8-10H2,1-3H3,(H,17,20)(H,18,19)/p-1/t12-/m0/s1