[methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino] 2,3,3-trimethylheptanoate

Systemtic Name: [methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino] 2,3,3-trimethylheptanoate Openeye Name: [methylsulfonyl(4-tetrahydropyran-2-yloxynonyl)amino] 2,3,3-trimethylheptanoate CAS Name: 2,3,3-trimethylheptanoic acid [methylsulfonyl-[4-(2-oxanyloxy)nonyl]amino] ester IUPAC Name: [methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino] 2,3,3-trimethylheptanoate Traditional Name: 2,3,3-trimethylenanthic acid [mesyl(4-tetrahydropyran-2-yloxynonyl)amino] ester Formula: C25H49NO6S MolecularWeight: 491.72466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCN(OC(=O)C(C)C(C)(C)CCCC)S(=O)(=O)C)OC1CCCCO1

Isomeric SMILES

CCCCCC(CCCN(OC(=O)C(C)C(C)(C)CCCC)S(=O)(=O)C)OC1CCCCO1

InChI

InChI=1S/C25H49NO6S/c1-7-9-11-15-22(31-23-17-12-13-20-30-23)16-14-19-26(33(6,28)29)32-24(27)21(3)25(4,5)18-10-8-2/h21-23H,7-20H2,1-6H3