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

Systemtic Name: N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-chloro-4-[4-[oxo-(4-propoxyphenyl)methyl]-1-piperazinyl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazino]phenyl]-5-nitro-2-furamide Formula: C25H25ClN4O6 MolecularWeight: 512.9422

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H25ClN4O6/c1-2-15-35-19-6-3-17(4-7-19)25(32)29-13-11-28(12-14-29)21-8-5-18(16-20(21)26)27-24(31)22-9-10-23(36-22)30(33)34/h3-10,16H,2,11-15H2,1H3,(H,27,31)