methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: methyl-[2-(4-nitroanilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: methyl-[2-(4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[2-(4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-(4-nitroanilino)ethyl]-methyl-(2-thenyl)ammonium Formula: C14H16N3O3S+ MolecularWeight: 306.36014

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O3S/c1-16(9-13-3-2-8-21-13)10-14(18)15-11-4-6-12(7-5-11)17(19)20/h2-8H,9-10H2,1H3,(H,15,18)/p+1