[(2S)-3-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-2-oxidanyl-propyl]-propan-2-yl-azanium

Systemtic Name: [(2S)-3-[4-(2-azanyl-2-oxidanylidene-ethyl)phenoxy]-2-oxidanyl-propyl]-propan-2-yl-azanium Openeye Name: [(2S)-3-[4-(2-amino-2-oxo-ethyl)phenoxy]-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2S)-3-[4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropyl]-propan-2-ylammonium IUPAC Name: [(2S)-3-[4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: [(2S)-3-[4-(2-amino-2-keto-ethyl)phenoxy]-2-hydroxy-propyl]-isopropyl-ammonium Formula: C14H23N2O3+ MolecularWeight: 267.34402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC(COC1=CC=C(C=C1)CC(=O)N)O

Isomeric SMILES

CC(C)[NH2+]C[C@@H](COC1=CC=C(C=C1)CC(=O)N)O

InChI

InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/p+1/t12-/m0/s1