N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: 5-nitro-N-[4-(4-p-toluoylpiperazino)phenyl]-2-furamide Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O5/c1-16-2-4-17(5-3-16)23(29)26-14-12-25(13-15-26)19-8-6-18(7-9-19)24-22(28)20-10-11-21(32-20)27(30)31/h2-11H,12-15H2,1H3,(H,24,28)