bis(propanoyloxymethyl) 3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylate

Systemtic Name: bis(propanoyloxymethyl) 3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylate Openeye Name: bis(propanoyloxymethyl) 3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylate CAS Name: 3,4-bis[oxo-[(4-phenoxyphenyl)methyl-propylamino]methyl]cyclobutane-1,2-dicarboxylic acid bis(1-oxopropoxymethyl) ester IUPAC Name: bis(propanoyloxymethyl) 3,4-bis[(4-phenoxyphenyl)methyl-propylcarbamoyl]cyclobutane-1,2-dicarboxylate Traditional Name: 3,4-bis[(4-phenoxybenzyl)-propyl-carbamoyl]cyclobutane-1,2-dicarboxylic acid bis(propionyloxymethyl) ester Formula: C48H54N2O12 MolecularWeight: 850.94856

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C48H54N2O12/c1-5-27-49(29-33-19-23-37(24-20-33)61-35-15-11-9-12-16-35)45(53)41-42(44(48(56)60-32-58-40(52)8-4)43(41)47(55)59-31-57-39(51)7-3)46(54)50(28-6-2)30-34-21-25-38(26-22-34)62-36-17-13-10-14-18-36/h9-26,41-44H,5-8,27-32H2,1-4H3