[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl N-(azepan-1-ylsulfonyl)carbamate

Systemtic Name: [(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl N-(azepan-1-ylsulfonyl)carbamate Openeye Name: [(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl N-(azepan-1-ylsulfonyl)carbamate CAS Name: N-(1-azepanylsulfonyl)carbamic acid [(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ester IUPAC Name: [(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl N-(azepan-1-ylsulfonyl)carbamate Traditional Name: N-(azepan-1-ylsulfonyl)carbamic acid [(3aR,5R,6S,6aR)-6-lauryloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ester Formula: C27H50N2O8S MolecularWeight: 562.7595

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1C(OC2C1OC(O2)(C)C)COC(=O)NS(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCCCCCCCCCO[C@H]1[C@H](O[C@H]2[C@@H]1OC(O2)(C)C)COC(=O)NS(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C27H50N2O8S/c1-4-5-6-7-8-9-10-11-14-17-20-33-23-22(35-25-24(23)36-27(2,3)37-25)21-34-26(30)28-38(31,32)29-18-15-12-13-16-19-29/h22-25H,4-21H2,1-3H3,(H,28,30)/t22-,23+,24-,25-/m1/s1