[2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(2-methoxy-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium Openeye Name: [2-(2-methoxy-4-nitro-anilino)-2-oxo-ethyl]-bis(2-thienylmethyl)ammonium CAS Name: [2-(2-methoxy-4-nitroanilino)-2-oxoethyl]-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-(2-methoxy-4-nitroanilino)-2-oxoethyl]-bis(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-(2-methoxy-4-nitro-anilino)ethyl]-bis(2-thenyl)ammonium Formula: C19H20N3O4S2+ MolecularWeight: 418.5098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

InChI

InChI=1S/C19H19N3O4S2/c1-26-18-10-14(22(24)25)6-7-17(18)20-19(23)13-21(11-15-4-2-8-27-15)12-16-5-3-9-28-16/h2-10H,11-13H2,1H3,(H,20,23)/p+1