[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-prop-2-ynyl-azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-prop-2-ynyl-azanium Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl]-prop-2-ynyl-ammonium CAS Name: [(2S)-1-anilino-1-oxopropan-2-yl]-prop-2-ynylammonium IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl]-prop-2-ynylazanium Traditional Name: [(1S)-2-anilino-2-keto-1-methyl-ethyl]-propargyl-ammonium Formula: C12H15N2O+ MolecularWeight: 203.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH2+]CC#C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH2+]CC#C

InChI

InChI=1S/C12H14N2O/c1-3-9-13-10(2)12(15)14-11-7-5-4-6-8-11/h1,4-8,10,13H,9H2,2H3,(H,14,15)/p+1/t10-/m0/s1