N-(furan-2-ylmethyl)-N-[1-(4-methoxyphenyl)-3-methyl-but-3-enyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-(furan-2-ylmethyl)-N-[1-(4-methoxyphenyl)-3-methyl-but-3-enyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-(2-furylmethyl)-N-[1-(4-methoxyphenyl)-3-methyl-but-3-enyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-(2-furanylmethyl)-N-[1-(4-methoxyphenyl)-3-methylbut-3-enyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-(furan-2-ylmethyl)-N-[1-(4-methoxyphenyl)-3-methylbut-3-enyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: 2-furfuryl-[1-(4-methoxyphenyl)-3-methyl-but-3-enyl]-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(C1=CC=C(C=C1)OC)N(CC2=CC=CO2)C3=C(N=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC(=C)CC(C1=CC=C(C=C1)OC)N(CC2=CC=CO2)C3=C(N=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4/c1-15(2)12-19(16-7-9-17(28-4)10-8-16)24(13-18-6-5-11-29-18)21-20(25(26)27)22-14-23(21)3/h5-11,14,19H,1,12-13H2,2-4H3