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

Systemtic Name: furan-2-ylmethyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[2-(4-nitroanilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[2-(4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[2-(4-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[2-keto-2-(4-nitroanilino)ethyl]-(2-thenyl)ammonium Formula: C18H18N3O4S+ MolecularWeight: 372.41822

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C[NH+](CC2=CC=CS2)CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C[NH+](CC2=CC=CS2)CC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c22-18(19-14-5-7-15(8-6-14)21(23)24)13-20(11-16-3-1-9-25-16)12-17-4-2-10-26-17/h1-10H,11-13H2,(H,19,22)/p+1