N-[[4-(3-azanylpyrrolidin-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[[4-(3-azanylpyrrolidin-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[[4-(3-aminopyrrolidin-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide CAS Name: N-[[4-(3-amino-1-pyrrolidinyl)phenyl]methyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[[4-(3-aminopyrrolidin-1-yl)phenyl]methyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-(3-aminopyrrolidino)benzyl]-5-nitro-2-furamide Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC1N)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O4/c17-12-7-8-19(10-12)13-3-1-11(2-4-13)9-18-16(21)14-5-6-15(24-14)20(22)23/h1-6,12H,7-10,17H2,(H,18,21)