N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-methyl-2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[4-(4-nitrophenyl)piperazino]ethyl]-2-furamide Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H20N4O5/c1-13(19-17(23)16-3-2-12-27-16)18(24)21-10-8-20(9-11-21)14-4-6-15(7-5-14)22(25)26/h2-7,12-13H,8-11H2,1H3,(H,19,23)/t13-/m0/s1