(2S)-2-[(2S,5S,6R)-5-methyl-8-oxidanylidene-6-phenylmethoxy-oxocan-2-yl]propanal

Systemtic Name: (2S)-2-[(2S,5S,6R)-5-methyl-8-oxidanylidene-6-phenylmethoxy-oxocan-2-yl]propanal Openeye Name: (2S)-2-[(2S,5S,6R)-6-benzyloxy-5-methyl-8-oxo-oxocan-2-yl]propanal CAS Name: (2S)-2-[(2S,5S,6R)-5-methyl-8-oxo-6-phenylmethoxy-2-oxocanyl]propanal IUPAC Name: (2S)-2-[(2S,5S,6R)-5-methyl-8-oxo-6-phenylmethoxyoxocan-2-yl]propanal Traditional Name: (2S)-2-[(2S,5S,6R)-6-benzoxy-8-keto-5-methyl-oxocan-2-yl]propionaldehyde Formula: C18H24O4 MolecularWeight: 304.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(OC(=O)CC1OCC2=CC=CC=C2)C(C)C=O

Isomeric SMILES

C[C@H]1CC[C@H](OC(=O)C[C@H]1OCC2=CC=CC=C2)[C@H](C)C=O

InChI

InChI=1S/C18H24O4/c1-13-8-9-16(14(2)11-19)22-18(20)10-17(13)21-12-15-6-4-3-5-7-15/h3-7,11,13-14,16-17H,8-10,12H2,1-2H3/t13-,14+,16-,17+/m0/s1