[(2R)-1-[(4-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]-ethyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(2R)-1-[(4-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]-ethyl-(thiophen-2-ylmethyl)azanium Openeye Name: [(1R)-2-(4-acetylanilino)-1-methyl-2-oxo-ethyl]-ethyl-(2-thienylmethyl)ammonium CAS Name: [(2R)-1-(4-acetylanilino)-1-oxopropan-2-yl]-ethyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(2R)-1-(4-acetylanilino)-1-oxopropan-2-yl]-ethyl-(thiophen-2-ylmethyl)azanium Traditional Name: [(1R)-2-(4-acetylanilino)-2-keto-1-methyl-ethyl]-ethyl-(2-thenyl)ammonium Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)C(C)C(=O)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC[NH+](CC1=CC=CS1)[C@H](C)C(=O)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C18H22N2O2S/c1-4-20(12-17-6-5-11-23-17)13(2)18(22)19-16-9-7-15(8-10-16)14(3)21/h5-11,13H,4,12H2,1-3H3,(H,19,22)/p+1/t13-/m1/s1