butan-1-ol; 2-methanidylpropan-2-ylbenzene; titanium

Systemtic Name: butan-1-ol; 2-methanidylpropan-2-ylbenzene; titanium Openeye Name: butan-1-ol; (1-methanidyl-1-methyl-ethyl)benzene; titanium CAS Name: 1-butanol; 2-methanidylpropan-2-ylbenzene; titanium IUPAC Name: butan-1-ol; 2-methanidylpropan-2-ylbenzene; titanium Traditional Name: butan-1-ol; (1-methanidyl-1-methyl-ethyl)benzene; titanium Formula: C22H43O3Ti- MolecularWeight: 403.44202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.CCCCO.CC(C)([CH2-])C1=CC=CC=C1.[Ti]

Isomeric SMILES

CCCCO.CCCCO.CCCCO.CC(C)([CH2-])C1=CC=CC=C1.[Ti]

InChI

InChI=1S/C10H13.3C4H10O.Ti/c1-10(2,3)9-7-5-4-6-8-9;3*1-2-3-4-5;/h4-8H,1H2,2-3H3;3*5H,2-4H2,1H3;/q-1;;;;