(Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidanidyl-methylidene]pyrrol-2-yl]-(4-iodophenyl)methyl]pyrrol-2-ylidene]methanolate; dibutyltin(2+)

Systemtic Name: (Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidanidyl-methylidene]pyrrol-2-yl]-(4-iodophenyl)methyl]pyrrol-2-ylidene]methanolate; dibutyltin(2+) Openeye Name: (Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxido-methylene]pyrrol-2-yl]-(4-iodophenyl)methyl]pyrrol-2-ylidene]methanolate; dibutyltin(2+) CAS Name: (Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidomethylidene]-2-pyrrolyl]-(4-iodophenyl)methyl]-2-pyrrolylidene]methanolate; dibutyltin(2+) IUPAC Name: (Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidomethylidene]pyrrol-2-yl]-(4-iodophenyl)methyl]pyrrol-2-ylidene]methanolate; dibutyltin(2+) Traditional Name: (Z)-(3,5-ditert-butylphenyl)-[5-[[(5Z)-5-[(3,5-ditert-butylphenyl)-oxido-methylene]pyrrol-2-yl]-(4-iodophenyl)methyl]pyrrol-2-ylidene]methanolate; dibutyltin(2+) Formula: C53H69IN2O2Sn MolecularWeight: 1011.74163

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.CC(C)(C)C1=CC(=CC(=C1)C(=C2C=CC(=N2)C(C3=CC=C(C=C3)I)C4=NC(=C(C5=CC(=CC(=C5)C(C)(C)C)C(C)(C)C)[O-])C=C4)[O-])C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C45H53IN2O2.2C4H9.Sn/c1-42(2,3)30-21-28(22-31(25-30)43(4,5)6)40(49)37-19-17-35(47-37)39(27-13-15-34(46)16-14-27)36-18-20-38(48-36)41(50)29-23-32(44(7,8)9)26-33(24-29)45(10,11)12;2*1-3-4-2;/h13-26,39,49-50H,1-12H3;2*1,3-4H2,2H3;/q;;;+2/p-2/b40-37-,41-38-;;;