2,4-bis[[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]cyclobutane-1,3-dicarboxylic acid

Systemtic Name: 2,4-bis[[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]carbonyl]cyclobutane-1,3-dicarboxylic acid Openeye Name: 2,4-bis[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]cyclobutane-1,3-dicarboxylic acid CAS Name: 2,4-bis[oxo-[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]cyclobutane-1,3-dicarboxylic acid IUPAC Name: 2,4-bis[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]cyclobutane-1,3-dicarboxylic acid Traditional Name: 2,4-bis[4-(4-phenoxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]cyclobutane-1,3-dicarboxylic acid Formula: C42H38N2O8 MolecularWeight: 698.75972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C4C(C(C4C(=O)O)C(=O)N5CCC(=CC5)C6=CC=C(C=C6)OC7=CC=CC=C7)C(=O)O

Isomeric SMILES

C1CN(CC=C1C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C4C(C(C4C(=O)O)C(=O)N5CCC(=CC5)C6=CC=C(C=C6)OC7=CC=CC=C7)C(=O)O

InChI

InChI=1S/C42H38N2O8/c45-39(43-23-19-29(20-24-43)27-11-15-33(16-12-27)51-31-7-3-1-4-8-31)35-37(41(47)48)36(38(35)42(49)50)40(46)44-25-21-30(22-26-44)28-13-17-34(18-14-28)52-32-9-5-2-6-10-32/h1-19,21,35-38H,20,22-26H2,(H,47,48)(H,49,50)