3,4-bis[bis(phenylmethyl)carbamoyl]cyclobutane-1,2-dicarboxylic acid

Systemtic Name: 3,4-bis[bis(phenylmethyl)carbamoyl]cyclobutane-1,2-dicarboxylic acid Openeye Name: 3,4-bis(dibenzylcarbamoyl)cyclobutane-1,2-dicarboxylic acid CAS Name: 3,4-bis[[bis(phenylmethyl)amino]-oxomethyl]cyclobutane-1,2-dicarboxylic acid IUPAC Name: 3,4-bis(dibenzylcarbamoyl)cyclobutane-1,2-dicarboxylic acid Traditional Name: 3,4-bis(dibenzylcarbamoyl)cyclobutane-1,2-dicarboxylic acid Formula: C36H34N2O6 MolecularWeight: 590.66496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)O)C(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)O)C(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C36H34N2O6/c39-33(37(21-25-13-5-1-6-14-25)22-26-15-7-2-8-16-26)29-30(32(36(43)44)31(29)35(41)42)34(40)38(23-27-17-9-3-10-18-27)24-28-19-11-4-12-20-28/h1-20,29-32H,21-24H2,(H,41,42)(H,43,44)