4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium

Systemtic Name: 4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium Openeye Name: 4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium CAS Name: 4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium IUPAC Name: 4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium Traditional Name: 4-(4-tert-butylphenyl)-2-methyl-1H-inden-1-ide; ethanol; methanidylbenzene; titanium Formula: C36H40OTi-4 MolecularWeight: 536.5692

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Descriptors Computed from Structure

Canonical SMILES:

C[CH-]O.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Ti]

Isomeric SMILES

C[CH-]O.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Ti]

InChI

InChI=1S/C20H21.2C7H7.C2H5O.Ti/c1-14-12-16-6-5-7-18(19(16)13-14)15-8-10-17(11-9-15)20(2,3)4;2*1-7-5-3-2-4-6-7;1-2-3;/h5-13H,1-4H3;2*2-6H,1H2;2-3H,1H3;/q4*-1;