dibutyltin(2+); (4-methylphenyl)-[5-[[5-[(4-methylphenyl)-oxidanyl-methyl]pyrrol-1-id-2-yl]-[4-(4-prop-2-enylhepta-1,6-dien-4-yl)phenyl]methyl]pyrrol-1-id-2-yl]methanol

Systemtic Name: dibutyltin(2+); (4-methylphenyl)-[5-[[5-[(4-methylphenyl)-oxidanyl-methyl]pyrrol-1-id-2-yl]-[4-(4-prop-2-enylhepta-1,6-dien-4-yl)phenyl]methyl]pyrrol-1-id-2-yl]methanol Openeye Name: [5-[[4-(1,1-diallylbut-3-enyl)phenyl]-[5-[hydroxy(p-tolyl)methyl]pyrrol-1-id-2-yl]methyl]pyrrol-1-id-2-yl]-(p-tolyl)methanol; dibutyltin(2+) CAS Name: dibutyltin(2+); [5-[[5-[hydroxy-(4-methylphenyl)methyl]-2-pyrrol-1-idyl]-[4-(4-prop-2-enylhepta-1,6-dien-4-yl)phenyl]methyl]-2-pyrrol-1-idyl]-(4-methylphenyl)methanol IUPAC Name: dibutyltin(2+); [5-[[5-[hydroxy-(4-methylphenyl)methyl]pyrrol-1-id-2-yl]-[4-(4-prop-2-enylhepta-1,6-dien-4-yl)phenyl]methyl]pyrrol-1-id-2-yl]-(4-methylphenyl)methanol Traditional Name: [5-[[4-(1,1-diallylbut-3-enyl)phenyl]-[5-[hydroxy(p-tolyl)methyl]pyrrol-1-id-2-yl]methyl]pyrrol-1-id-2-yl]-(p-tolyl)methanol; dibutyltin(2+) Formula: C49H60N2O2Sn MolecularWeight: 827.7229

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.CC1=CC=C(C=C1)C(C2=CC=C([N-]2)C(C3=CC=C(C=C3)C(CC=C)(CC=C)CC=C)C4=CC=C([N-]4)C(C5=CC=C(C=C5)C)O)O

Isomeric SMILES

CCCC[Sn+2]CCCC.CC1=CC=C(C=C1)C(C2=CC=C([N-]2)C(C3=CC=C(C=C3)C(CC=C)(CC=C)CC=C)C4=CC=C([N-]4)C(C5=CC=C(C=C5)C)O)O

InChI

InChI=1S/C41H42N2O2.2C4H9.Sn/c1-6-25-41(26-7-2,27-8-3)33-19-17-30(18-20-33)38(34-21-23-36(42-34)39(44)31-13-9-28(4)10-14-31)35-22-24-37(43-35)40(45)32-15-11-29(5)12-16-32;2*1-3-4-2;/h6-24,38-40,44-45H,1-3,25-27H2,4-5H3;2*1,3-4H2,2H3;/q-2;;;+2