2-[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-oxidanylidene-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-oxo-2-(tetralin-1-ylamino)ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]thio]benzoic acid IUPAC Name: 2-[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-keto-2-(tetralin-1-ylamino)ethyl]thio]benzoic acid Formula: C19H19NO3S MolecularWeight: 341.42406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)NC(=O)CSC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)NC(=O)CSC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H19NO3S/c21-18(12-24-17-11-4-3-9-15(17)19(22)23)20-16-10-5-7-13-6-1-2-8-14(13)16/h1-4,6,8-9,11,16H,5,7,10,12H2,(H,20,21)(H,22,23)