naphthalen-1-ol; 4,5,6,7-tetrahydroindene; titanium

Systemtic Name: naphthalen-1-ol; 4,5,6,7-tetrahydroindene; titanium Openeye Name: naphthalen-1-ol; 4,5,6,7-tetrahydroindene; titanium CAS Name: 1-naphthalenol; 4,5,6,7-tetrahydroindene; titanium IUPAC Name: naphthalen-1-ol; 4,5,6,7-tetrahydroindene; titanium Traditional Name: 1-naphthol; 4,5,6,7-tetrahydroindene; titanium Formula: C38H38O2Ti MolecularWeight: 574.57412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[C]2[CH][CH][CH][C]2C1.C1CC[C]2[CH][CH][CH][C]2C1.C1=CC=C2C(=C1)C=CC=C2O.C1=CC=C2C(=C1)C=CC=C2O.[Ti]

Isomeric SMILES

C1CC[C]2[CH][CH][CH][C]2C1.C1CC[C]2[CH][CH][CH][C]2C1.C1=CC=C2C(=C1)C=CC=C2O.C1=CC=C2C(=C1)C=CC=C2O.[Ti]

InChI

InChI=1S/2C10H8O.2C9H11.Ti/c2*11-10-7-3-5-8-4-1-2-6-9(8)10;2*1-2-5-9-7-3-6-8(9)4-1;/h2*1-7,11H;2*3,6-7H,1-2,4-5H2;