N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-[4-(2-furoyl)piperazino]phenyl]-2-methyl-3-nitro-benzamide Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

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