[3,5-dimethyl-4-[2-oxidanylidene-2-(propylamino)ethoxy]phenyl]methylazanium

Systemtic Name: [3,5-dimethyl-4-[2-oxidanylidene-2-(propylamino)ethoxy]phenyl]methylazanium Openeye Name: [3,5-dimethyl-4-[2-oxo-2-(propylamino)ethoxy]phenyl]methylammonium CAS Name: [3,5-dimethyl-4-[2-oxo-2-(propylamino)ethoxy]phenyl]methylammonium IUPAC Name: [3,5-dimethyl-4-[2-oxo-2-(propylamino)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-(propylamino)ethoxy]-3,5-dimethyl-benzyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC1=C(C=C(C=C1C)C[NH3+])C

Isomeric SMILES

CCCNC(=O)COC1=C(C=C(C=C1C)C[NH3+])C

InChI

InChI=1S/C14H22N2O2/c1-4-5-16-13(17)9-18-14-10(2)6-12(8-15)7-11(14)3/h6-7H,4-5,8-9,15H2,1-3H3,(H,16,17)/p+1