butanoic acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylidenetitanium

Systemtic Name: butanoic acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylidenetitanium Openeye Name: butyric acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium CAS Name: butanoic acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium IUPAC Name: butanoic acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylidenetitanium Traditional Name: butyric acid; cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium Formula: C23H30O4Ti-2 MolecularWeight: 418.3489

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)O.CCCC(=O)O.C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21

Isomeric SMILES

CCCC(=O)O.CCCC(=O)O.C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21

InChI

InChI=1S/C9H7.C5H5.2C4H8O2.CH2.Ti/c1-2-5-9-7-3-6-8(9)4-1;1-2-4-5-3-1;2*1-2-3-4(5)6;;/h1-7H;1-3H,4H2;2*2-3H2,1H3,(H,5,6);1H2;/q2*-1;;;;