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

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-5-(3-nitrophenyl)-2-furamide Formula: C29H25ClN4O5 MolecularWeight: 544.9856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H25ClN4O5/c1-19-5-2-3-8-23(19)29(36)33-15-13-32(14-16-33)25-10-9-21(18-24(25)30)31-28(35)27-12-11-26(39-27)20-6-4-7-22(17-20)34(37)38/h2-12,17-18H,13-16H2,1H3,(H,31,35)