furan-2-ylmethyl-[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl]-(2-thenyl)ammonium Formula: C20H22N3O5S+ MolecularWeight: 416.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CS3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-14-9-18(23(25)26)19(27-2)10-17(14)21-20(24)13-22(11-15-5-3-7-28-15)12-16-6-4-8-29-16/h3-10H,11-13H2,1-2H3,(H,21,24)/p+1