(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 4-tert-butylcyclohexane-1-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 4-tert-butylcyclohexane-1-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 4-tert-butylcyclohexanecarboxylate CAS Name: 4-tert-butyl-1-cyclohexanecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 4-tert-butylcyclohexane-1-carboxylate Traditional Name: 4-tert-butylcyclohexanecarboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H28O4 MolecularWeight: 392.48742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28O4/c1-25(2,3)19-11-8-17(9-12-19)24(27)28-15-18-14-22(26)29-21-13-10-16-6-4-5-7-20(16)23(18)21/h4-7,10,13-14,17,19H,8-9,11-12,15H2,1-3H3