4-[[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-methyl-amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[[2-(2-furylmethylamino)-2-oxo-ethyl]-methyl-amino]methyl]-3-nitro-benzamide CAS Name: 4-[[[2-(2-furanylmethylamino)-2-oxoethyl]-methylamino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[[2-(furan-2-ylmethylamino)-2-oxoethyl]-methylamino]methyl]-3-nitrobenzamide Traditional Name: 4-[[[2-(2-furfurylamino)-2-keto-ethyl]-methyl-amino]methyl]-3-nitro-benzamide Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])CC(=O)NCC2=CC=CO2

Isomeric SMILES

CN(CC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])CC(=O)NCC2=CC=CO2

InChI

InChI=1S/C16H18N4O5/c1-19(10-15(21)18-8-13-3-2-6-25-13)9-12-5-4-11(16(17)22)7-14(12)20(23)24/h2-7H,8-10H2,1H3,(H2,17,22)(H,18,21)