(4-methoxyphenyl)methyl (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methyl-hexanoate

Systemtic Name: (4-methoxyphenyl)methyl (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methyl-hexanoate Openeye Name: (4-methoxyphenyl)methyl (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methyl-hexanoate CAS Name: (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methylhexanoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methylhexanoate Traditional Name: (2S,3R)-2-(2-azidoethyl)-3-[[(R)-tert-butylsulfinyl]amino]-5-methyl-hexanoic acid p-anisyl ester Formula: C21H34N4O4S MolecularWeight: 438.58406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CCN=[N+]=[N-])C(=O)OCC1=CC=C(C=C1)OC)NS(=O)C(C)(C)C

Isomeric SMILES

CC(C)C[C@H]([C@H](CCN=[N+]=[N-])C(=O)OCC1=CC=C(C=C1)OC)N[S@](=O)C(C)(C)C

InChI

InChI=1S/C21H34N4O4S/c1-15(2)13-19(24-30(27)21(3,4)5)18(11-12-23-25-22)20(26)29-14-16-7-9-17(28-6)10-8-16/h7-10,15,18-19,24H,11-14H2,1-6H3/t18-,19+,30+/m0/s1