dimethyl-[(2R)-2-phenyl-2-[(1-thiophen-3-ylcarbonylpiperidin-4-yl)carbonylamino]ethyl]azanium

Systemtic Name: dimethyl-[(2R)-2-phenyl-2-[(1-thiophen-3-ylcarbonylpiperidin-4-yl)carbonylamino]ethyl]azanium Openeye Name: dimethyl-[(2R)-2-phenyl-2-[[1-(thiophene-3-carbonyl)piperidine-4-carbonyl]amino]ethyl]ammonium CAS Name: dimethyl-[(2R)-2-[[oxo-[1-[oxo(3-thiophenyl)methyl]-4-piperidinyl]methyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2R)-2-phenyl-2-[[1-(thiophene-3-carbonyl)piperidine-4-carbonyl]amino]ethyl]azanium Traditional Name: dimethyl-[(2R)-2-phenyl-2-[[1-(3-thenoyl)isonipecotoyl]amino]ethyl]ammonium Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CSC=C3

Isomeric SMILES

C[NH+](C)C[C@@H](C1=CC=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=CSC=C3

InChI

InChI=1S/C21H27N3O2S/c1-23(2)14-19(16-6-4-3-5-7-16)22-20(25)17-8-11-24(12-9-17)21(26)18-10-13-27-15-18/h3-7,10,13,15,17,19H,8-9,11-12,14H2,1-2H3,(H,22,25)/p+1/t19-/m0/s1