(3S,4R)-3-[2-[(1S)-1,3-dimethyl-4-oxidanylidene-cyclohex-2-en-1-yl]ethyl]-3-methyl-4-propan-2-yl-hexanedial

Systemtic Name: (3S,4R)-3-[2-[(1S)-1,3-dimethyl-4-oxidanylidene-cyclohex-2-en-1-yl]ethyl]-3-methyl-4-propan-2-yl-hexanedial Openeye Name: (3S,4R)-3-[2-[(1S)-1,3-dimethyl-4-oxo-cyclohex-2-en-1-yl]ethyl]-4-isopropyl-3-methyl-hexanedial CAS Name: (3S,4R)-3-[2-[(1S)-1,3-dimethyl-4-oxo-1-cyclohex-2-enyl]ethyl]-3-methyl-4-propan-2-ylhexanedial IUPAC Name: (3S,4R)-3-[2-[(1S)-1,3-dimethyl-4-oxocyclohex-2-en-1-yl]ethyl]-3-methyl-4-propan-2-ylhexanedial Traditional Name: (3S,4R)-4-isopropyl-3-[2-[(1S)-4-keto-1,3-dimethyl-cyclohex-2-en-1-yl]ethyl]-3-methyl-adipaldehyde Formula: C20H32O3 MolecularWeight: 320.46628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(CCC1=O)(C)CCC(C)(CC=O)C(CC=O)C(C)C

Isomeric SMILES

CC1=C[C@@](CCC1=O)(C)CC[C@@](C)(CC=O)[C@H](CC=O)C(C)C

InChI

InChI=1S/C20H32O3/c1-15(2)17(7-12-21)20(5,11-13-22)10-9-19(4)8-6-18(23)16(3)14-19/h12-15,17H,6-11H2,1-5H3/t17-,19-,20+/m1/s1