tert-butyl N-[(4S,5S)-4-(6-dodecylpyridin-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate

Systemtic Name: tert-butyl N-[(4S,5S)-4-(6-dodecylpyridin-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate Openeye Name: tert-butyl N-[(4S,5S)-4-(6-dodecyl-2-pyridyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate CAS Name: N-[(4S,5S)-4-(6-dodecyl-2-pyridinyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4S,5S)-4-(6-dodecylpyridin-2-yl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate Traditional Name: N-[(4S,5S)-4-(6-lauryl-2-pyridyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamic acid tert-butyl ester Formula: C28H48N2O4 MolecularWeight: 476.69172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC(=N1)C2C(COC(O2)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC(=N1)[C@@H]2[C@H](COC(O2)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H48N2O4/c1-7-8-9-10-11-12-13-14-15-16-18-22-19-17-20-23(29-22)25-24(21-32-28(5,6)33-25)30-26(31)34-27(2,3)4/h17,19-20,24-25H,7-16,18,21H2,1-6H3,(H,30,31)/t24-,25+/m0/s1