(3R,12R,14S)-12,14-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]-15-phenylmethoxy-pentadecan-7-ol

Systemtic Name: (3R,12R,14S)-12,14-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]-15-phenylmethoxy-pentadecan-7-ol Openeye Name: (3R,12R,14S)-15-benzyloxy-12,14-dimethyl-3-(p-tolylsulfonylmethyl)pentadecan-7-ol CAS Name: (3R,12R,14S)-12,14-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]-15-phenylmethoxy-7-pentadecanol IUPAC Name: (3R,12R,14S)-12,14-dimethyl-3-[(4-methylphenyl)sulfonylmethyl]-15-phenylmethoxypentadecan-7-ol Traditional Name: (3R,12R,14S)-15-benzoxy-12,14-dimethyl-3-(tosylmethyl)pentadecan-7-ol Formula: C32H50O4S MolecularWeight: 530.802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC(CCCCC(C)CC(C)COCC1=CC=CC=C1)O)CS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC[C@H](CCCC(CCCC[C@@H](C)C[C@H](C)COCC1=CC=CC=C1)O)CS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C32H50O4S/c1-5-29(25-37(34,35)32-20-18-26(2)19-21-32)15-11-17-31(33)16-10-9-12-27(3)22-28(4)23-36-24-30-13-7-6-8-14-30/h6-8,13-14,18-21,27-29,31,33H,5,9-12,15-17,22-25H2,1-4H3/t27-,28+,29-,31?/m1/s1