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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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