(1-oxidaniumylidene-4-oxidanylidene-naphthalen-2-yl)oxidanium; propan-2-yloxidanium; titanium

Systemtic Name: (1-oxidaniumylidene-4-oxidanylidene-naphthalen-2-yl)oxidanium; propan-2-yloxidanium; titanium Openeye Name: isopropyloxonium; (4-oxo-2-oxonio-1-naphthylidene)oxonium; titanium CAS Name: (4-oxo-2-oxonio-1-naphthalenylidene)oxonium; propan-2-yloxonium; titanium IUPAC Name: (4-oxo-2-oxonionaphthalen-1-ylidene)oxidanium; propan-2-yloxidanium; titanium Traditional Name: isopropyloxonium; (4-keto-2-oxonio-1-naphthylidene)oxonium; titanium Formula: C26H34O8Ti+6 MolecularWeight: 522.41036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[OH2+].CC(C)[OH2+].C1=CC=C2C(=C1)C(=O)C=C(C2=[OH+])[OH2+].C1=CC=C2C(=C1)C(=O)C=C(C2=[OH+])[OH2+].[Ti]

Isomeric SMILES

CC(C)[OH2+].CC(C)[OH2+].C1=CC=C2C(=C1)C(=O)C=C(C2=[OH+])[OH2+].C1=CC=C2C(=C1)C(=O)C=C(C2=[OH+])[OH2+].[Ti]

InChI

InChI=1S/2C10H6O3.2C3H8O.Ti/c2*11-8-5-9(12)10(13)7-4-2-1-3-6(7)8;2*1-3(2)4;/h2*1-5,12H;2*3-4H,1-2H3;/p+6