[(4R)-1-[(3-methoxyphenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(naphthalen-1-ylmethyl)azanium

Systemtic Name: [(4R)-1-[(3-methoxyphenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(naphthalen-1-ylmethyl)azanium Openeye Name: [(4R)-1-[(3-methoxyphenyl)methyl]-7-oxo-azepan-4-yl]-methyl-(1-naphthylmethyl)ammonium CAS Name: [(4R)-1-[(3-methoxyphenyl)methyl]-7-oxo-4-azepanyl]-methyl-(1-naphthalenylmethyl)ammonium IUPAC Name: [(4R)-1-[(3-methoxyphenyl)methyl]-7-oxoazepan-4-yl]-methyl-(naphthalen-1-ylmethyl)azanium Traditional Name: [(4R)-7-keto-1-m-anisyl-azepan-4-yl]-methyl-(1-naphthylmethyl)ammonium Formula: C26H31N2O2+ MolecularWeight: 403.53654

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC2=CC=CC=C21)C3CCC(=O)N(CC3)CC4=CC(=CC=C4)OC

Isomeric SMILES

C[NH+](CC1=CC=CC2=CC=CC=C21)[C@@H]3CCC(=O)N(CC3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H30N2O2/c1-27(19-22-10-6-9-21-8-3-4-12-25(21)22)23-13-14-26(29)28(16-15-23)18-20-7-5-11-24(17-20)30-2/h3-12,17,23H,13-16,18-19H2,1-2H3/p+1/t23-/m1/s1