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

Systemtic Name: tert-butyl N-[(4R,5S)-4-(3-dodecylphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate Openeye Name: tert-butyl N-[(4R,5S)-4-(3-dodecylphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate CAS Name: N-[(4R,5S)-4-(3-dodecylphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4R,5S)-4-(3-dodecylphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamate Traditional Name: N-[(4R,5S)-4-(3-laurylphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]carbamic acid tert-butyl ester Formula: C29H49NO4 MolecularWeight: 475.70366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC(=C1)C2C(COC(O2)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC(=C1)[C@@H]2[C@H](COC(O2)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C29H49NO4/c1-7-8-9-10-11-12-13-14-15-16-18-23-19-17-20-24(21-23)26-25(22-32-29(5,6)33-26)30-27(31)34-28(2,3)4/h17,19-21,25-26H,7-16,18,22H2,1-6H3,(H,30,31)/t25-,26+/m0/s1