[4-[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium Openeye Name: [4-[(1S)-2-(3-methoxypropylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [4-[(1S)-2-keto-2-(3-methoxypropylamino)-1-methyl-ethoxy]benzyl]ammonium Formula: C14H23N2O3+ MolecularWeight: 267.34402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCOC)OC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCCOC)OC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C14H22N2O3/c1-11(14(17)16-8-3-9-18-2)19-13-6-4-12(10-15)5-7-13/h4-7,11H,3,8-10,15H2,1-2H3,(H,16,17)/p+1/t11-/m0/s1