methyl 2,2-dimethyl-7-[methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino]heptanoate

Systemtic Name: methyl 2,2-dimethyl-7-[methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino]heptanoate Openeye Name: methyl 2,2-dimethyl-7-[methylsulfonyl(4-tetrahydropyran-2-yloxynonyl)amino]heptanoate CAS Name: 2,2-dimethyl-7-[methylsulfonyl-[4-(2-oxanyloxy)nonyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-7-[methylsulfonyl-[4-(oxan-2-yloxy)nonyl]amino]heptanoate Traditional Name: 7-[mesyl(4-tetrahydropyran-2-yloxynonyl)amino]-2,2-dimethyl-enanthic acid methyl ester Formula: C25H49NO6S MolecularWeight: 491.72466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H49NO6S/c1-6-7-9-15-22(32-23-17-10-13-21-31-23)16-14-20-26(33(5,28)29)19-12-8-11-18-25(2,3)24(27)30-4/h22-23H,6-21H2,1-5H3