(Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidanidyl-methylidene]pyrrol-2-yl]methyl]pyrrol-2-ylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+)

Systemtic Name: (Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidanidyl-methylidene]pyrrol-2-yl]methyl]pyrrol-2-ylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+) Openeye Name: (Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxido-methylene]pyrrol-2-yl]methyl]pyrrol-2-ylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+) CAS Name: (Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidomethylidene]-2-pyrrolyl]methyl]-2-pyrrolylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+) IUPAC Name: (Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxidomethylidene]pyrrol-2-yl]methyl]pyrrol-2-ylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+) Traditional Name: (Z)-[5-[[4-[bis(1H-pyrrol-2-yl)methyl]phenyl]-[(5Z)-5-[(3,5-ditert-butylphenyl)-oxido-methylene]pyrrol-2-yl]methyl]pyrrol-2-ylidene]-(3,5-ditert-butylphenyl)methanolate; dibutyltin(2+) Formula: C62H78N4O2Sn MolecularWeight: 1030.01832

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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)C(C4=CC=CN4)C5=CC=CN5)C6=NC(=C(C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)[O-])C=C6)[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)C(C6=CC=CN6)C7=CC=CN7)/[O-])C(C)(C)C)(C)C

InChI

InChI=1S/C54H62N4O2.2C4H9.Sn/c1-51(2,3)37-27-35(28-38(31-37)52(4,5)6)49(59)45-23-21-43(57-45)48(34-19-17-33(18-20-34)47(41-15-13-25-55-41)42-16-14-26-56-42)44-22-24-46(58-44)50(60)36-29-39(53(7,8)9)32-40(30-36)54(10,11)12;2*1-3-4-2;/h13-32,47-48,55-56,59-60H,1-12H3;2*1,3-4H2,2H3;/q;;;+2/p-2/b49-45-,50-46-;;;