[(2R)-4-[(4-methylphenyl)methyl]-1,4-oxazepan-4-ium-2-yl]methylazanium

Systemtic Name: [(2R)-4-[(4-methylphenyl)methyl]-1,4-oxazepan-4-ium-2-yl]methylazanium Openeye Name: [(2R)-4-(p-tolylmethyl)-1,4-oxazepan-4-ium-2-yl]methylammonium CAS Name: [(2R)-4-[(4-methylphenyl)methyl]-1,4-oxazepan-4-ium-2-yl]methylammonium IUPAC Name: [(2R)-4-[(4-methylphenyl)methyl]-1,4-oxazepan-4-ium-2-yl]methylazanium Traditional Name: [(2R)-4-(4-methylbenzyl)-1,4-oxazepan-4-ium-2-yl]methylammonium Formula: C14H24N2O+2 MolecularWeight: 236.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCCOC(C2)C[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCCO[C@@H](C2)C[NH3+]

InChI

InChI=1S/C14H22N2O/c1-12-3-5-13(6-4-12)10-16-7-2-8-17-14(9-15)11-16/h3-6,14H,2,7-11,15H2,1H3/p+2/t14-/m1/s1