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

Systemtic Name: [2-oxidanylidene-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] 4-methylsulfinylbenzoate Openeye Name: [2-oxo-2-(1-tetralin-6-ylethylamino)ethyl] 4-methylsulfinylbenzoate CAS Name: 4-methylsulfinylbenzoic acid [2-oxo-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] 4-methylsulfinylbenzoate Traditional Name: 4-methylsulfinylbenzoic acid [2-keto-2-(1-tetralin-6-ylethylamino)ethyl] ester Formula: C22H25NO4S MolecularWeight: 399.5032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(CCCC2)C=C1)NC(=O)COC(=O)C3=CC=C(C=C3)S(=O)C

Isomeric SMILES

CC(C1=CC2=C(CCCC2)C=C1)NC(=O)COC(=O)C3=CC=C(C=C3)S(=O)C

InChI

InChI=1S/C22H25NO4S/c1-15(18-8-7-16-5-3-4-6-19(16)13-18)23-21(24)14-27-22(25)17-9-11-20(12-10-17)28(2)26/h7-13,15H,3-6,14H2,1-2H3,(H,23,24)