methyl (2S)-2-[2-(4-hydroxyphenyl)-3-methyl-4-oxidanylidene-azetidin-1-yl]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[2-(4-hydroxyphenyl)-3-methyl-4-oxidanylidene-azetidin-1-yl]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[2-(4-hydroxyphenyl)-3-methyl-4-oxo-azetidin-1-yl]-4-methyl-pentanoate CAS Name: (2S)-2-[2-(4-hydroxyphenyl)-3-methyl-4-oxo-1-azetidinyl]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(4-hydroxyphenyl)-3-methyl-4-oxoazetidin-1-yl]-4-methylpentanoate Traditional Name: (2S)-2-[2-(4-hydroxyphenyl)-4-keto-3-methyl-azetidin-1-yl]-4-methyl-valeric acid methyl ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(C1=O)C(CC(C)C)C(=O)OC)C2=CC=C(C=C2)O

Isomeric SMILES

CC1C(N(C1=O)[C@@H](CC(C)C)C(=O)OC)C2=CC=C(C=C2)O

InChI

InChI=1S/C17H23NO4/c1-10(2)9-14(17(21)22-4)18-15(11(3)16(18)20)12-5-7-13(19)8-6-12/h5-8,10-11,14-15,19H,9H2,1-4H3/t11?,14-,15?/m0/s1