[(4R)-1-[(4-methoxyphenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-phenethyl-azanium

Systemtic Name: [(4R)-1-[(4-methoxyphenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-phenethyl-azanium Openeye Name: [(4R)-1-[(4-methoxyphenyl)methyl]-7-oxo-azepan-4-yl]-methyl-phenethyl-ammonium CAS Name: [(4R)-1-[(4-methoxyphenyl)methyl]-7-oxo-4-azepanyl]-methyl-phenethylammonium IUPAC Name: [(4R)-1-[(4-methoxyphenyl)methyl]-7-oxoazepan-4-yl]-methyl-phenethylazanium Traditional Name: [(4R)-7-keto-1-p-anisyl-azepan-4-yl]-methyl-phenethyl-ammonium Formula: C23H31N2O2+ MolecularWeight: 367.50444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@@H]2CCC(=O)N(CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H30N2O2/c1-24(16-14-19-6-4-3-5-7-19)21-10-13-23(26)25(17-15-21)18-20-8-11-22(27-2)12-9-20/h3-9,11-12,21H,10,13-18H2,1-2H3/p+1/t21-/m1/s1