methyl (2S)-1-[(2R)-3,3-dicyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[(2R)-3,3-dicyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-3,3-dicyclohexyl-propanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2R)-3,3-dicyclohexyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[(2R)-3,3-dicyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-3,3-dicyclohexyl-propanoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C26H44N2O5 MolecularWeight: 464.63796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(C1CCCCC1)C2CCCCC2)C(=O)N3CCCC3C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C(C1CCCCC1)C2CCCCC2)C(=O)N3CCC[C@H]3C(=O)OC

InChI

InChI=1S/C26H44N2O5/c1-26(2,3)33-25(31)27-22(23(29)28-17-11-16-20(28)24(30)32-4)21(18-12-7-5-8-13-18)19-14-9-6-10-15-19/h18-22H,5-17H2,1-4H3,(H,27,31)/t20-,22+/m0/s1