(2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; propan-2-olate; titanium(4+)

Systemtic Name: (2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; propan-2-olate; titanium(4+) Openeye Name: (2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; propan-2-olate; titanium(4+) CAS Name: (2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; 2-propanolate; titanium(4+) IUPAC Name: (2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; propan-2-olate; titanium(4+) Traditional Name: (2E,4E)-hexa-2,4-diene; 1H-inden-1-ide; propan-2-olate; titanium(4+) Formula: C24H38O3Ti MolecularWeight: 422.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC.CC(C)[O-].CC(C)[O-].CC(C)[O-].[CH-]1C=CC2=CC=CC=C21.[Ti+4]

Isomeric SMILES

C/C=C/C=C/C.CC([O-])C.CC([O-])C.CC([O-])C.[CH-]1C2=CC=CC=C2C=C1.[Ti+4]

InChI

InChI=1S/C9H7.C6H10.3C3H7O.Ti/c1-2-5-9-7-3-6-8(9)4-1;1-3-5-6-4-2;3*1-3(2)4;/h1-7H;3-6H,1-2H3;3*3H,1-2H3;/q-1;;3*-1;+4/b;5-3+,6-4+;;;;