tert-butyl 2-[2-azanyl-3-[(1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl)amino]-3-oxidanylidene-2-[(4-phenylmethoxyphenyl)methyl]propanoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[2-azanyl-3-[(1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl)amino]-3-oxidanylidene-2-[(4-phenylmethoxyphenyl)methyl]propanoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[2-amino-3-[[2-amino-1-(benzyloxymethyl)-2-oxo-ethyl]amino]-2-[(4-benzyloxyphenyl)methyl]-3-oxo-propanoyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-amino-3-[(1-amino-1-oxo-3-phenylmethoxypropan-2-yl)amino]-1,3-dioxo-2-[(4-phenylmethoxyphenyl)methyl]propyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-amino-3-[(1-amino-1-oxo-3-phenylmethoxypropan-2-yl)amino]-3-oxo-2-[(4-phenylmethoxyphenyl)methyl]propanoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-amino-3-[[2-amino-1-(benzoxymethyl)-2-keto-ethyl]amino]-2-(4-benzoxybenzyl)-3-keto-propanoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C36H44N4O7 MolecularWeight: 644.75716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)(C(=O)NC(COCC4=CC=CC=C4)C(=O)N)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)(C(=O)NC(COCC4=CC=CC=C4)C(=O)N)N

InChI

InChI=1S/C36H44N4O7/c1-35(2,3)47-34(44)40-20-10-15-30(40)31(41)36(38,21-25-16-18-28(19-17-25)46-23-27-13-8-5-9-14-27)33(43)39-29(32(37)42)24-45-22-26-11-6-4-7-12-26/h4-9,11-14,16-19,29-30H,10,15,20-24,38H2,1-3H3,(H2,37,42)(H,39,43)