butanoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+)

Systemtic Name: butanoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+) Openeye Name: butyric acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+) CAS Name: butanoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+) IUPAC Name: butanoic acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+) Traditional Name: butyric acid; carbanide; 2,3,4,5,6,7,8,9-octahydro-1H-fluoren-1-ide; titanium(2+) Formula: C22H36O4Ti MolecularWeight: 412.38584

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].CCCC(=O)O.CCCC(=O)O.C1CCC2=C(C1)CC3=C2CCC[CH-]3.[Ti+2]

Isomeric SMILES

[CH3-].CCCC(=O)O.CCCC(=O)O.C1CCC2=C(C1)CC3=C2CCC[CH-]3.[Ti+2]

InChI

InChI=1S/C13H17.2C4H8O2.CH3.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-2-3-4(5)6;;/h5H,1-4,6-9H2;2*2-3H2,1H3,(H,5,6);1H3;/q-1;;;-1;+2