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3,15-dimethyl-9-oxidanylidene-3,15-diphenyl-heptadecanedioic acid

3,15-dimethyl-9-oxidanylidene-3,15-diphenyl-heptadecanedioic acid

Systemtic Name:3,15-dimethyl-9-oxidanylidene-3,15-diphenyl-heptadecanedioic acid
Openeye Name:3,15-dimethyl-9-oxo-3,15-diphenyl-heptadecanedioic acid
CAS Name:3,15-dimethyl-9-oxo-3,15-diphenylheptadecanedioic acid
IUPAC Name:3,15-dimethyl-9-oxo-3,15-diphenylheptadecanedioic acid
Traditional Name:9-keto-3,15-dimethyl-3,15-diphenyl-heptadecanedioic acid
Formula: C31H42O5
MolecularWeight: 494.66218
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC(=O)CCCCCC(C)(CC(=O)O)C1=CC=CC=C1)(CC(=O)O)C2=CC=CC=C2


Isomeric SMILES

CC(CCCCCC(=O)CCCCCC(C)(CC(=O)O)C1=CC=CC=C1)(CC(=O)O)C2=CC=CC=C2


InChI

InChI=1S/C31H42O5/c1-30(23-28(33)34,25-15-7-3-8-16-25)21-13-5-11-19-27(32)20-12-6-14-22-31(2,24-29(35)36)26-17-9-4-10-18-26/h3-4,7-10,15-18H,5-6,11-14,19-24H2,1-2H3,(H,33,34)(H,35,36)


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