2,4-bis[2-methyl-2-(4-methylphenyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol

Systemtic Name: 2,4-bis[2-methyl-2-(4-methylphenyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol Openeye Name: 2,4-bis[2-methyl-2-(p-tolyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol CAS Name: 2,4-bis[2-methyl-2-(4-methylphenyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol IUPAC Name: 2,4-bis[2-methyl-2-(4-methylphenyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol Traditional Name: 2,4-bis[2-methyl-2-(p-tolyl)-1,3-dihydroperimidin-6-yl]cyclobutane-1,3-diol Formula: C42H40N4O2 MolecularWeight: 632.7926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(NC3=C4C(=C(C=C3)C5C(C(C5O)C6=C7C=CC=C8C7=C(C=C6)NC(N8)(C)C9=CC=C(C=C9)C)O)C=CC=C4N2)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(NC3=C4C(=C(C=C3)C5C(C(C5O)C6=C7C=CC=C8C7=C(C=C6)NC(N8)(C)C9=CC=C(C=C9)C)O)C=CC=C4N2)C

InChI

InChI=1S/C42H40N4O2/c1-23-11-15-25(16-12-23)41(3)43-31-9-5-7-27-29(19-21-33(45-41)35(27)31)37-39(47)38(40(37)48)30-20-22-34-36-28(30)8-6-10-32(36)44-42(4,46-34)26-17-13-24(2)14-18-26/h5-22,37-40,43-48H,1-4H3