tert-butyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-2-[(3-phenylphenoxy)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-2-[(3-phenylphenoxy)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(tert-butoxycarbonylamino)acetyl]amino]-2-[(3-phenylphenoxy)methyl]pyrrolidine-1-carboxylate CAS Name: 4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-2-[(3-phenylphenoxy)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-2-[(3-phenylphenoxy)methyl]pyrrolidine-1-carboxylate Traditional Name: 4-[[2-(tert-butoxycarbonylamino)acetyl]amino]-2-[(3-phenylphenoxy)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C29H39N3O6 MolecularWeight: 525.63646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)NC1CC(N(C1)C(=O)OC(C)(C)C)COC2=CC=CC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NC1CC(N(C1)C(=O)OC(C)(C)C)COC2=CC=CC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C29H39N3O6/c1-28(2,3)37-26(34)30-17-25(33)31-22-16-23(32(18-22)27(35)38-29(4,5)6)19-36-24-14-10-13-21(15-24)20-11-8-7-9-12-20/h7-15,22-23H,16-19H2,1-6H3,(H,30,34)(H,31,33)