(3R,4R,9S,12E)-3-chloranyl-4-methoxy-9-methyl-15-phenylmethoxy-pentadeca-1,12-diene-6,10-dione

Systemtic Name: (3R,4R,9S,12E)-3-chloranyl-4-methoxy-9-methyl-15-phenylmethoxy-pentadeca-1,12-diene-6,10-dione Openeye Name: (3R,4R,9S,12E)-15-benzyloxy-3-chloro-4-methoxy-9-methyl-pentadeca-1,12-diene-6,10-dione CAS Name: (3R,4R,9S,12E)-3-chloro-4-methoxy-9-methyl-15-phenylmethoxypentadeca-1,12-diene-6,10-dione IUPAC Name: (3R,4R,9S,12E)-3-chloro-4-methoxy-9-methyl-15-phenylmethoxypentadeca-1,12-diene-6,10-dione Traditional Name: (3R,4R,9S,12E)-15-benzoxy-3-chloro-4-methoxy-9-methyl-pentadeca-1,12-diene-6,10-dione Formula: C24H33ClO4 MolecularWeight: 420.96942

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)CC(C(C=C)Cl)OC)C(=O)CC=CCCOCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCC(=O)C[C@H]([C@@H](C=C)Cl)OC)C(=O)C/C=C/CCOCC1=CC=CC=C1

InChI

InChI=1S/C24H33ClO4/c1-4-22(25)24(28-3)17-21(26)15-14-19(2)23(27)13-9-6-10-16-29-18-20-11-7-5-8-12-20/h4-9,11-12,19,22,24H,1,10,13-18H2,2-3H3/b9-6+/t19-,22+,24+/m0/s1