methyl 2-[[(3S,4R,5S)-2,4-diethanoyl-5-methyl-5-oxidanyl-3-phenyl-cyclohexen-1-yl]amino]ethanoate

Systemtic Name: methyl 2-[[(3S,4R,5S)-2,4-diethanoyl-5-methyl-5-oxidanyl-3-phenyl-cyclohexen-1-yl]amino]ethanoate Openeye Name: methyl 2-[[(3S,4R,5S)-2,4-diacetyl-5-hydroxy-5-methyl-3-phenyl-cyclohexen-1-yl]amino]acetate CAS Name: 2-[[(3S,4R,5S)-2,4-diacetyl-5-hydroxy-5-methyl-3-phenyl-1-cyclohexenyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(3S,4R,5S)-2,4-diacetyl-5-hydroxy-5-methyl-3-phenylcyclohexen-1-yl]amino]acetate Traditional Name: 2-[[(3S,4R,5S)-2,4-diacetyl-5-hydroxy-5-methyl-3-phenyl-cyclohexen-1-yl]amino]acetic acid methyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(=C(CC1(C)O)NCC(=O)OC)C(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)[C@@H]1[C@H](C(=C(C[C@]1(C)O)NCC(=O)OC)C(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C20H25NO5/c1-12(22)17-15(21-11-16(24)26-4)10-20(3,25)19(13(2)23)18(17)14-8-6-5-7-9-14/h5-9,18-19,21,25H,10-11H2,1-4H3/t18-,19+,20-/m0/s1