[(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: [(1R)-2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl]-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: [(1R)-2-(1,3-benzodioxol-5-ylamino)-2-keto-1-methyl-ethyl]-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C16H19N2O3S+ MolecularWeight: 319.39866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH2+]C(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C1=CC=CS1)[NH2+][C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H18N2O3S/c1-10(15-4-3-7-22-15)17-11(2)16(19)18-12-5-6-13-14(8-12)21-9-20-13/h3-8,10-11,17H,9H2,1-2H3,(H,18,19)/p+1/t10-,11-/m1/s1