7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]-3-nitro-2-oxidanyl-chromen-4-one

Systemtic Name: 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-hydroxy-propoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-hydroxypropoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-hydroxypropoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[3-[4-(4-chlorobenzyl)piperazino]-2-hydroxy-propoxy]-2-hydroxy-3-nitro-chromone Formula: C23H24ClN3O7 MolecularWeight: 489.90556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)CC(COC3=CC4=C(C=C3)C(=O)C(=C(O4)O)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)CC(COC3=CC4=C(C=C3)C(=O)C(=C(O4)O)[N+](=O)[O-])O

InChI

InChI=1S/C23H24ClN3O7/c24-16-3-1-15(2-4-16)12-25-7-9-26(10-8-25)13-17(28)14-33-18-5-6-19-20(11-18)34-23(30)21(22(19)29)27(31)32/h1-6,11,17,28,30H,7-10,12-14H2