cyclopenta-1,3-diene; methylidenetitanium; prop-2-enoic acid

Systemtic Name: cyclopenta-1,3-diene; methylidenetitanium; prop-2-enoic acid Openeye Name: acrylic acid; cyclopenta-1,3-diene; methylenetitanium CAS Name: cyclopenta-1,3-diene; methylenetitanium; 2-propenoic acid IUPAC Name: cyclopenta-1,3-diene; methylidenetitanium; prop-2-enoic acid Traditional Name: acrylic acid; cyclopenta-1,3-diene; methylenetitanium Formula: C17H20O4Ti-2 MolecularWeight: 336.2053

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)O.C=CC(=O)O.C=[Ti].C1C=CC=[C-]1.C1C=CC=[C-]1

Isomeric SMILES

C=CC(=O)O.C=CC(=O)O.C=[Ti].C1C=CC=[C-]1.C1C=CC=[C-]1

InChI

InChI=1S/2C5H5.2C3H4O2.CH2.Ti/c2*1-2-4-5-3-1;2*1-2-3(4)5;;/h2*1-3H,4H2;2*2H,1H2,(H,4,5);1H2;/q2*-1;;;;