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

Systemtic Name: tert-butyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]-2-[(3-phenylmethoxyphenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(3-benzyloxyphenyl)carbamoyl]-4-[[2-(tert-butoxycarbonylamino)acetyl]amino]pyrrolidine-1-carboxylate CAS Name: 4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-2-[oxo-(3-phenylmethoxyanilino)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-2-[(3-phenylmethoxyphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(3-benzoxyphenyl)carbamoyl]-4-[[2-(tert-butoxycarbonylamino)acetyl]amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H40N4O7 MolecularWeight: 568.6612

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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)C(=O)NC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NC1CC(N(C1)C(=O)OC(C)(C)C)C(=O)NC2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C30H40N4O7/c1-29(2,3)40-27(37)31-17-25(35)32-22-16-24(34(18-22)28(38)41-30(4,5)6)26(36)33-21-13-10-14-23(15-21)39-19-20-11-8-7-9-12-20/h7-15,22,24H,16-19H2,1-6H3,(H,31,37)(H,32,35)(H,33,36)