3-[(4-phenoxyphenyl)methyl-(phenylmethyl)carbamoyl]-4-[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylic acid

Systemtic Name: 3-[(4-phenoxyphenyl)methyl-(phenylmethyl)carbamoyl]-4-[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylic acid Openeye Name: 3-[benzyl-[(4-phenoxyphenyl)methyl]carbamoyl]-4-[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1,2-dicarboxylic acid CAS Name: 3-[oxo-[(4-phenoxyphenyl)methyl-(phenylmethyl)amino]methyl]-4-[oxo-[(4-phenoxyphenyl)methyl-propylamino]methyl]cyclobutane-1,2-dicarboxylic acid IUPAC Name: 3-[benzyl-[(4-phenoxyphenyl)methyl]carbamoyl]-4-[(4-phenoxyphenyl)methyl-propylcarbamoyl]cyclobutane-1,2-dicarboxylic acid Traditional Name: 3-[benzyl-(4-phenoxybenzyl)carbamoyl]-4-[(4-phenoxybenzyl)-propyl-carbamoyl]cyclobutane-1,2-dicarboxylic acid Formula: C44H42N2O8 MolecularWeight: 726.81288

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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)O)C(=O)O)C(=O)N(CC4=CC=CC=C4)CC5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)O)C(=O)N(CC4=CC=CC=C4)CC5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C44H42N2O8/c1-2-26-45(27-31-18-22-35(23-19-31)53-33-14-8-4-9-15-33)41(47)37-38(40(44(51)52)39(37)43(49)50)42(48)46(28-30-12-6-3-7-13-30)29-32-20-24-36(25-21-32)54-34-16-10-5-11-17-34/h3-25,37-40H,2,26-29H2,1H3,(H,49,50)(H,51,52)