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

Systemtic Name: 4-phenethyl-10-propan-2-yl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Openeye Name: 10-isopropyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium CAS Name: 4-phenethyl-10-propan-2-yl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium IUPAC Name: 4-phenethyl-10-propan-2-yl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Traditional Name: 10-isopropyl-4-phenethyl-2,3,4,5-tetrahydro-[1,4]oxazepino[7,6-b]quinolin-4-ium Formula: C23H27N2O+ MolecularWeight: 347.47328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=CC3=C(N=C21)OCC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=CC2=CC3=C(N=C21)OCC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O/c1-17(2)21-10-6-9-19-15-20-16-25(12-11-18-7-4-3-5-8-18)13-14-26-23(20)24-22(19)21/h3-10,15,17H,11-14,16H2,1-2H3/p+1