N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: 5-(3-nitrophenyl)-N-[4-(4-o-toluoylpiperazino)phenyl]-2-furamide Formula: C29H26N4O5 MolecularWeight: 510.54054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H26N4O5/c1-20-5-2-3-8-25(20)29(35)32-17-15-31(16-18-32)23-11-9-22(10-12-23)30-28(34)27-14-13-26(38-27)21-6-4-7-24(19-21)33(36)37/h2-14,19H,15-18H2,1H3,(H,30,34)