N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-chloro-2-(4-isobutyrylpiperazino)phenyl]-5-nitro-2-furamide Formula: C19H21ClN4O5 MolecularWeight: 420.84684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O5/c1-12(2)19(26)23-10-8-22(9-11-23)17-13(20)4-3-5-14(17)21-18(25)15-6-7-16(29-15)24(27)28/h3-7,12H,8-11H2,1-2H3,(H,21,25)