(4-dimethylaminophenyl)oxidanium; [(Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-ylidene]oxidanium; titanium

Systemtic Name: (4-dimethylaminophenyl)oxidanium; [(Z)-2,2,6,6-tetramethyl-5-oxidanyl-hept-4-en-3-ylidene]oxidanium; titanium Openeye Name: [(Z)-1-tert-butyl-3-hydroxy-4,4-dimethyl-pent-2-enylidene]oxonium; (4-dimethylaminophenyl)oxonium; titanium CAS Name: (4-dimethylaminophenyl)oxonium; [(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-ylidene]oxonium; titanium IUPAC Name: (4-dimethylaminophenyl)oxidanium; [(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-ylidene]oxidanium; titanium Traditional Name: [(Z)-1-tert-butyl-3-hydroxy-4,4-dimethyl-pent-2-enylidene]oxonium; (4-dimethylaminophenyl)oxonium; titanium Formula: C38H66N2O6Ti+4 MolecularWeight: 694.80744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=CC(=[OH+])C(C)(C)C)O.CC(C)(C)C(=CC(=[OH+])C(C)(C)C)O.CN(C)C1=CC=C(C=C1)[OH2+].CN(C)C1=CC=C(C=C1)[OH2+].[Ti]

Isomeric SMILES

CC(/C(=C/C(=[OH+])C(C)(C)C)/O)(C)C.CC(/C(=C/C(=[OH+])C(C)(C)C)/O)(C)C.CN(C1=CC=C(C=C1)[OH2+])C.CN(C1=CC=C(C=C1)[OH2+])C.[Ti]

InChI

InChI=1S/2C11H20O2.2C8H11NO.Ti/c2*1-10(2,3)8(12)7-9(13)11(4,5)6;2*1-9(2)7-3-5-8(10)6-4-7;/h2*7,12H,1-6H3;2*3-6,10H,1-2H3;/p+4/b2*8-7-;;;