[4-[2-[[(1R,2R,3R)-3-(7-methoxy-7-oxidanylidene-heptyl)-2-[(E,4S)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanylidene-cyclopentyl]oxy-di(propan-2-yl)silyl]ethyl]phenyl]methyl-trimethyl-azanium chloride

Systemtic Name: [4-[2-[[(1R,2R,3R)-3-(7-methoxy-7-oxidanylidene-heptyl)-2-[(E,4S)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanylidene-cyclopentyl]oxy-di(propan-2-yl)silyl]ethyl]phenyl]methyl-trimethyl-azanium chloride Openeye Name: [4-[2-[[(1R,2R,3R)-2-[(E,4S)-4-hydroxy-4-methyl-oct-1-enyl]-3-(7-methoxy-7-oxo-heptyl)-4-oxo-cyclopentoxy]-diisopropyl-silyl]ethyl]phenyl]methyl-trimethyl-ammonium chloride CAS Name: [4-[2-[[(1R,2R,3R)-2-[(E,4S)-4-hydroxy-4-methyloct-1-enyl]-3-(7-methoxy-7-oxoheptyl)-4-oxocyclopentyl]oxy-di(propan-2-yl)silyl]ethyl]phenyl]methyl-trimethylammonium chloride IUPAC Name: [4-[2-[[(1R,2R,3R)-2-[(E,4S)-4-hydroxy-4-methyloct-1-enyl]-3-(7-methoxy-7-oxoheptyl)-4-oxocyclopentyl]oxy-di(propan-2-yl)silyl]ethyl]phenyl]methyl-trimethylazanium chloride Traditional Name: [4-[2-[[(1R,2R,3R)-2-[(E,4S)-4-hydroxy-4-methyl-oct-1-enyl]-4-keto-3-(7-keto-7-methoxy-heptyl)cyclopentoxy]-diisopropyl-silyl]ethyl]benzyl]-trimethyl-ammonium chloride Formula: C40H70ClNO5Si MolecularWeight: 708.526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CCCCCCC(=O)OC)O[Si](CCC2=CC=C(C=C2)C[N+](C)(C)C)(C(C)C)C(C)C)O.[Cl-]

Isomeric SMILES

CCCC[C@@](C)(C/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)OC)O[Si](CCC2=CC=C(C=C2)C[N+](C)(C)C)(C(C)C)C(C)C)O.[Cl-]

InChI

InChI=1S/C40H70NO5Si.ClH/c1-11-12-26-40(6,44)27-17-19-36-35(18-15-13-14-16-20-39(43)45-10)37(42)29-38(36)46-47(31(2)3,32(4)5)28-25-33-21-23-34(24-22-33)30-41(7,8)9;/h17,19,21-24,31-32,35-36,38,44H,11-16,18,20,25-30H2,1-10H3;1H/q+1;/p-1/b19-17+;/t35-,36-,38-,40+;/m1./s1