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

Systemtic Name: butyl-[(4R)-1-[(4-methoxyphenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-azanium Openeye Name: butyl-[(4R)-1-[(4-methoxyphenyl)methyl]-7-oxo-azepan-4-yl]-methyl-ammonium CAS Name: butyl-[(4R)-1-[(4-methoxyphenyl)methyl]-7-oxo-4-azepanyl]-methylammonium IUPAC Name: butyl-[(4R)-1-[(4-methoxyphenyl)methyl]-7-oxoazepan-4-yl]-methylazanium Traditional Name: butyl-[(4R)-7-keto-1-p-anisyl-azepan-4-yl]-methyl-ammonium Formula: C19H31N2O2+ MolecularWeight: 319.46164

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CCC(=O)N(CC1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCC[NH+](C)[C@@H]1CCC(=O)N(CC1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H30N2O2/c1-4-5-13-20(2)17-8-11-19(22)21(14-12-17)15-16-6-9-18(23-3)10-7-16/h6-7,9-10,17H,4-5,8,11-15H2,1-3H3/p+1/t17-/m1/s1