[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 4-oxidanylidene-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 4-oxidanylidene-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 4-oxo-4-tetralin-6-yl-butanoate CAS Name: 4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoate Traditional Name: 4-keto-4-tetralin-6-yl-butyric acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C26H33NO4 MolecularWeight: 423.54452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H33NO4/c28-23(22-6-5-20-3-1-2-4-21(20)12-22)7-8-25(30)31-16-24(29)27-26-13-17-9-18(14-26)11-19(10-17)15-26/h5-6,12,17-19H,1-4,7-11,13-16H2,(H,27,29)