methyl 1-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate Openeye Name: methyl 4-(3-benzyloxypropoxy)-1-[2-(tert-butoxycarbonylamino)-2-cyclohexyl-acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-cyclohexyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]-4-(3-phenylmethoxypropoxy)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]-4-(3-phenylmethoxypropoxy)pyrrolidine-2-carboxylate Traditional Name: 4-(3-benzoxypropoxy)-1-[2-(tert-butoxycarbonylamino)-2-cyclohexyl-acetyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C29H44N2O7 MolecularWeight: 532.66886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1CCCCC1)C(=O)N2CC(CC2C(=O)OC)OCCCOCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1CCCCC1)C(=O)N2CC(CC2C(=O)OC)OCCCOCC3=CC=CC=C3

InChI

InChI=1S/C29H44N2O7/c1-29(2,3)38-28(34)30-25(22-14-9-6-10-15-22)26(32)31-19-23(18-24(31)27(33)35-4)37-17-11-16-36-20-21-12-7-5-8-13-21/h5,7-8,12-13,22-25H,6,9-11,14-20H2,1-4H3,(H,30,34)