tert-butyl 4-[2-azanylethanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-[(4-phenylphenoxy)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-azanylethanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-[(4-phenylphenoxy)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-aminoacetyl)-tert-butoxycarbonyl-amino]-2-[(4-phenylphenoxy)methyl]pyrrolidine-1-carboxylate CAS Name: 4-[(2-amino-1-oxoethyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[(4-phenylphenoxy)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-aminoacetyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-[(4-phenylphenoxy)methyl]pyrrolidine-1-carboxylate Traditional Name: 4-[tert-butoxycarbonyl(glycyl)amino]-2-[(4-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)N1CC(CC1COC2=CC=C(C=C2)C3=CC=CC=C3)N(C(=O)CN)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1COC2=CC=C(C=C2)C3=CC=CC=C3)N(C(=O)CN)C(=O)OC(C)(C)C

InChI

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