16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxidanylidenetitanium

Systemtic Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxidanylidenetitanium Openeye Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxotitanium CAS Name: 16-methyl-1-heptadecanone; 2-methyl-2-propenoic acid; oxotitanium IUPAC Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxotitanium Traditional Name: ketotitanium; methacrylic acid; 16-methylheptadecan-1-one Formula: C26H47O6Ti- MolecularWeight: 503.51478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCC[C-]=O.CC(=C)C(=O)O.CC(=C)C(=O)O.O=[Ti]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCC[C-]=O.CC(=C)C(=O)O.CC(=C)C(=O)O.O=[Ti]

InChI

InChI=1S/C18H35O.2C4H6O2.O.Ti/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19;2*1-3(2)4(5)6;;/h18H,3-16H2,1-2H3;2*1H2,2H3,(H,5,6);;/q-1;;;;