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

Systemtic Name: cyclopenta-1,3-diene; 1H-inden-1-ide; methylidenetitanium; naphthalene-1-carboxylic acid Openeye Name: cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium; naphthalene-1-carboxylic acid CAS Name: cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium; 1-naphthalenecarboxylic acid IUPAC Name: cyclopenta-1,3-diene; 1H-inden-1-ide; methylidenetitanium; naphthalene-1-carboxylic acid Traditional Name: cyclopenta-1,3-diene; 1H-inden-1-ide; methylenetitanium; 1-naphthoic acid Formula: C37H30O4Ti-2 MolecularWeight: 586.4987

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Descriptors Computed from Structure

Canonical SMILES:

C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21.C1=CC=C2C(=C1)C=CC=C2C(=O)O.C1=CC=C2C(=C1)C=CC=C2C(=O)O

Isomeric SMILES

C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21.C1=CC=C2C(=C1)C=CC=C2C(=O)O.C1=CC=C2C(=C1)C=CC=C2C(=O)O

InChI

InChI=1S/2C11H8O2.C9H7.C5H5.CH2.Ti/c2*12-11(13)10-7-3-5-8-4-1-2-6-9(8)10;1-2-5-9-7-3-6-8(9)4-1;1-2-4-5-3-1;;/h2*1-7H,(H,12,13);1-7H;1-3H,4H2;1H2;/q;;2*-1;;