[4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl]oxidanium; [(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium; titanium

Systemtic Name: [4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl]oxidanium; [(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium; titanium Openeye Name: [4-[1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenyl]oxonium; [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium; titanium CAS Name: [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxonium; [4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl]oxonium; titanium IUPAC Name: [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxidanium; [4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenyl]oxidanium; titanium Traditional Name: [4-[1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenyl]oxonium; [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium; titanium Formula: C66H68O8Ti+4 MolecularWeight: 1037.10832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(CC)C1=CC=C(C=C1)O)C2=CC=C(C=C2)[OH2+].CCC(=C(CC)C1=CC=C(C=C1)O)C2=CC=C(C=C2)[OH2+].C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.[Ti]

Isomeric SMILES

CCC(=C(C1=CC=C(C=C1)O)CC)C2=CC=C(C=C2)[OH2+].CCC(=C(C1=CC=C(C=C1)O)CC)C2=CC=C(C=C2)[OH2+].C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.[Ti]

InChI

InChI=1S/2C18H20O2.2C15H12O2.Ti/c2*1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14;2*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;/h2*5-12,19-20H,3-4H2,1-2H3;2*1-11,16H;/p+4/b;;2*14-11-;