tert-butyl N-[(3S,4S)-1-hexadecyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S,4S)-1-hexadecyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[(3S,4S)-4-(tert-butoxycarbonylamino)-1-hexadecyl-pyrrolidin-3-yl]carbamate CAS Name: N-[(3S,4S)-1-hexadecyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S,4S)-1-hexadecyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidin-3-yl]carbamate Traditional Name: N-[(3S,4S)-4-(tert-butoxycarbonylamino)-1-cetyl-pyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C30H59N3O4 MolecularWeight: 525.80716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1CC(C(C1)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C[C@@H]([C@H](C1)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H59N3O4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-33-23-25(31-27(34)36-29(2,3)4)26(24-33)32-28(35)37-30(5,6)7/h25-26H,8-24H2,1-7H3,(H,31,34)(H,32,35)/t25-,26-/m0/s1