methyl 2-methyl-5-[[methyl-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyl-amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[methyl-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyl-amino]methyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[methyl-(3-nitro-4-pyrrolidin-1-yl-benzoyl)amino]methyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[methyl-[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[methyl-(3-nitro-4-pyrrolidin-1-ylbenzoyl)amino]methyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[methyl-(3-nitro-4-pyrrolidino-benzoyl)amino]methyl]furan-3-carboxylic acid methyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C20H23N3O6/c1-13-16(20(25)28-3)11-15(29-13)12-21(2)19(24)14-6-7-17(18(10-14)23(26)27)22-8-4-5-9-22/h6-7,10-11H,4-5,8-9,12H2,1-3H3