tert-butyl N-[(3S,4S,5S,6S,7S)-7-azanyl-8-cyclohexyl-3-methyl-5,6-bis(oxidanyl)octan-4-yl]carbamate

Systemtic Name: tert-butyl N-[(3S,4S,5S,6S,7S)-7-azanyl-8-cyclohexyl-3-methyl-5,6-bis(oxidanyl)octan-4-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S,3S,4S)-4-amino-5-cyclohexyl-2,3-dihydroxy-1-[(1S)-1-methylpropyl]pentyl]carbamate CAS Name: N-[(3S,4S,5S,6S,7S)-7-amino-8-cyclohexyl-5,6-dihydroxy-3-methyloctan-4-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S,4S,5S,6S,7S)-7-amino-8-cyclohexyl-5,6-dihydroxy-3-methyloctan-4-yl]carbamate Traditional Name: N-[(1S,2S,3S,4S)-4-amino-5-cyclohexyl-2,3-dihydroxy-1-[(1S)-1-methylpropyl]pentyl]carbamic acid tert-butyl ester Formula: C20H40N2O4 MolecularWeight: 372.5426

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C(C(CC1CCCCC1)N)O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H]([C@@H]([C@H]([C@H](CC1CCCCC1)N)O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H40N2O4/c1-6-13(2)16(22-19(25)26-20(3,4)5)18(24)17(23)15(21)12-14-10-8-7-9-11-14/h13-18,23-24H,6-12,21H2,1-5H3,(H,22,25)/t13-,15-,16-,17-,18-/m0/s1