5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-5-ium

Systemtic Name: 5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-5-ium Openeye Name: 5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridin-5-ium CAS Name: 5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridin-5-ium IUPAC Name: 5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-5-ium Traditional Name: 5-cyclopentyl-3-phenyl-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridin-5-ium Formula: C17H21N2O+ MolecularWeight: 269.36144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC3=C(C2)C(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCC3=C(C2)C(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C17H20N2O/c1-2-6-13(7-3-1)17-15-12-19(14-8-4-5-9-14)11-10-16(15)20-18-17/h1-3,6-7,14H,4-5,8-12H2/p+1