methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: methyl-[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: methyl-[2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: methyl-[2-(2-methyl-6-nitroanilino)-2-oxoethyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-keto-2-(2-methyl-6-nitro-anilino)ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C16H20N3O3S+ MolecularWeight: 334.4133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3S/c1-11-7-8-23-14(11)9-18(3)10-15(20)17-16-12(2)5-4-6-13(16)19(21)22/h4-8H,9-10H2,1-3H3,(H,17,20)/p+1