(4-aminocarbonylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium Openeye Name: (4-carbamoylphenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]-(2-thienylmethyl)ammonium CAS Name: (4-carbamoylphenyl)methyl-[[(2R)-2-oxolanyl]methyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: (4-carbamoylphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]-(thiophen-2-ylmethyl)azanium Traditional Name: (4-carbamoylbenzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]-(2-thenyl)ammonium Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH+](CC2=CC=C(C=C2)C(=O)N)CC3=CC=CS3

Isomeric SMILES

C1C[C@@H](OC1)C[NH+](CC2=CC=C(C=C2)C(=O)N)CC3=CC=CS3

InChI

InChI=1S/C18H22N2O2S/c19-18(21)15-7-5-14(6-8-15)11-20(12-16-3-1-9-22-16)13-17-4-2-10-23-17/h2,4-8,10,16H,1,3,9,11-13H2,(H2,19,21)/p+1/t16-/m1/s1