10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium

Systemtic Name: 10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Openeye Name: 10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium CAS Name: 10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium IUPAC Name: 10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Traditional Name: 10-ethyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Formula: C22H25N2O+ MolecularWeight: 333.4467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=CC3=C(N=C21)OCC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC2=CC3=C(N=C21)OCC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O/c1-2-18-9-6-10-19-15-20-16-24(12-11-17-7-4-3-5-8-17)13-14-25-22(20)23-21(18)19/h3-10,15H,2,11-14,16H2,1H3/p+1