methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1-carboxylate

Systemtic Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1-carboxylate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutanecarboxylate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3,4-bis[oxo-[(4-phenoxyphenyl)methyl-propylamino]methyl]-1-cyclobutanecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-bis[(4-phenoxyphenyl)methyl-propylcarbamoyl]cyclobutane-1-carboxylate Traditional Name: 2-(tert-butoxycarbonylamino)-3,4-bis[(4-phenoxybenzyl)-propyl-carbamoyl]cyclobutanecarboxylic acid methyl ester Formula: C45H53N3O8 MolecularWeight: 763.91762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)OC)NC(=O)OC(C)(C)C)C(=O)N(CCC)CC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)OC)NC(=O)OC(C)(C)C)C(=O)N(CCC)CC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C45H53N3O8/c1-7-27-47(29-31-19-23-35(24-20-31)54-33-15-11-9-12-16-33)41(49)37-38(40(39(37)43(51)53-6)46-44(52)56-45(3,4)5)42(50)48(28-8-2)30-32-21-25-36(26-22-32)55-34-17-13-10-14-18-34/h9-26,37-40H,7-8,27-30H2,1-6H3,(H,46,52)