[(2R)-4-azanyl-4-oxidanylidene-butan-2-yl]-[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]azanium

Systemtic Name: [(2R)-4-azanyl-4-oxidanylidene-butan-2-yl]-[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]azanium Openeye Name: [(1R)-3-amino-1-methyl-3-oxo-propyl]-[(2R)-2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]ammonium CAS Name: [(2R)-4-amino-4-oxobutan-2-yl]-[(2R)-2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]ammonium IUPAC Name: [(2R)-4-amino-4-oxobutan-2-yl]-[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]azanium Traditional Name: [(1R)-3-amino-3-keto-1-methyl-propyl]-[(2R)-2-(4-methylpiperidino)-2-(2-thienyl)ethyl]ammonium Formula: C16H28N3OS+ MolecularWeight: 310.47802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(C[NH2+]C(C)CC(=O)N)C2=CC=CS2

Isomeric SMILES

CC1CCN(CC1)[C@H](C[NH2+][C@H](C)CC(=O)N)C2=CC=CS2

InChI

InChI=1S/C16H27N3OS/c1-12-5-7-19(8-6-12)14(15-4-3-9-21-15)11-18-13(2)10-16(17)20/h3-4,9,12-14,18H,5-8,10-11H2,1-2H3,(H2,17,20)/p+1/t13-,14-/m1/s1