[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium

Systemtic Name: [2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium Openeye Name: [2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium CAS Name: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-methyl-[(5-methyl-2-furanyl)methyl]ammonium IUPAC Name: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: [2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C17H22N3O5+ MolecularWeight: 348.37368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](C)CC(=O)NC2=CC(=C(C=C2C)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(O1)C[NH+](C)CC(=O)NC2=CC(=C(C=C2C)[N+](=O)[O-])OC

InChI

InChI=1S/C17H21N3O5/c1-11-7-15(20(22)23)16(24-4)8-14(11)18-17(21)10-19(3)9-13-6-5-12(2)25-13/h5-8H,9-10H2,1-4H3,(H,18,21)/p+1