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

Systemtic Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxidanylidenetitanium; propane Openeye Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxotitanium; propane CAS Name: 16-methyl-1-heptadecanone; 2-methyl-2-propenoic acid; oxotitanium; propane IUPAC Name: 16-methylheptadecan-1-one; 2-methylprop-2-enoic acid; oxotitanium; propane Traditional Name: ketotitanium; methacrylic acid; 16-methylheptadecan-1-one; propane Formula: C29H54O6Ti-2 MolecularWeight: 546.60246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H35O.2C4H6O2.C3H7.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;1-3-2;;/h18H,3-16H2,1-2H3;2*1H2,2H3,(H,5,6);3H,1-2H3;;/q-1;;;-1;;