carbanide; N-[3,3-dibutyl-5-(propanoylamino)cyclohexyl]propanamide; titanium(2+)

Systemtic Name: carbanide; N-[3,3-dibutyl-5-(propanoylamino)cyclohexyl]propanamide; titanium(2+) Openeye Name: carbanide; N-[3,3-dibutyl-5-(propanoylamino)cyclohexyl]propanamide; titanium(2+) CAS Name: carbanide; N-[3,3-dibutyl-5-(1-oxopropylamino)cyclohexyl]propanamide; titanium(2+) IUPAC Name: carbanide; N-[3,3-dibutyl-5-(propanoylamino)cyclohexyl]propanamide; titanium(2+) Traditional Name: carbanide; N-(3,3-dibutyl-5-propionamido-cyclohexyl)propionamide; titanium(2+) Formula: C22H44N2O2Ti MolecularWeight: 416.46396

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CCCCC1(CC(CC(C1)NC(=O)CC)NC(=O)CC)CCCC.[Ti+2]

Isomeric SMILES

[CH3-].[CH3-].CCCCC1(CC(CC(C1)NC(=O)CC)NC(=O)CC)CCCC.[Ti+2]

InChI

InChI=1S/C20H38N2O2.2CH3.Ti/c1-5-9-11-20(12-10-6-2)14-16(21-18(23)7-3)13-17(15-20)22-19(24)8-4;;;/h16-17H,5-15H2,1-4H3,(H,21,23)(H,22,24);2*1H3;/q;2*-1;+2