methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: methyl-[2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-(2-methyl-6-nitro-anilino)ethyl]-methyl-(2-thenyl)ammonium Formula: C15H18N3O3S+ MolecularWeight: 320.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=CS2

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=CS2

InChI

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