[(3S)-2,5-bis(oxidanylidene)-1-phenethyl-pyrrolidin-3-yl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [(3S)-2,5-bis(oxidanylidene)-1-phenethyl-pyrrolidin-3-yl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [(3S)-2,5-dioxo-1-phenethyl-pyrrolidin-3-yl]-methyl-(3-thienylmethyl)ammonium CAS Name: [(3S)-2,5-dioxo-1-phenethyl-3-pyrrolidinyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [(3S)-2,5-dioxo-1-phenethylpyrrolidin-3-yl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [(3S)-2,5-diketo-1-phenethyl-pyrrolidin-3-yl]-methyl-(3-thenyl)ammonium Formula: C18H21N2O2S+ MolecularWeight: 329.43654

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)C2CC(=O)N(C2=O)CCC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CSC=C1)[C@H]2CC(=O)N(C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c1-19(12-15-8-10-23-13-15)16-11-17(21)20(18(16)22)9-7-14-5-3-2-4-6-14/h2-6,8,10,13,16H,7,9,11-12H2,1H3/p+1/t16-/m0/s1