methyl-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(2-nitroanilino)ethyl]-methyl-(3-thenyl)ammonium Formula: C15H18N3O3S+ MolecularWeight: 320.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+](C)CC2=CSC=C2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])[NH+](C)CC2=CSC=C2

InChI

InChI=1S/C15H17N3O3S/c1-11(17(2)9-12-7-8-22-10-12)15(19)16-13-5-3-4-6-14(13)18(20)21/h3-8,10-11H,9H2,1-2H3,(H,16,19)/p+1/t11-/m1/s1