methyl-(naphthalen-2-ylmethyl)-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: methyl-(naphthalen-2-ylmethyl)-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [(2S)-1-anilino-1-oxopropan-2-yl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [(1S)-2-anilino-2-keto-1-methyl-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C21H23N2O+ MolecularWeight: 319.42012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH+](C)CC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H22N2O/c1-16(21(24)22-20-10-4-3-5-11-20)23(2)15-17-12-13-18-8-6-7-9-19(18)14-17/h3-14,16H,15H2,1-2H3,(H,22,24)/p+1/t16-/m0/s1