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

Systemtic Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]ethoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[2-[4-(4-chlorobenzyl)piperazino]ethoxy]-2-hydroxy-3-nitro-chromone Formula: C22H22ClN3O6 MolecularWeight: 459.87958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O6/c23-16-3-1-15(2-4-16)14-25-9-7-24(8-10-25)11-12-31-17-5-6-18-19(13-17)32-22(28)20(21(18)27)26(29)30/h1-6,13,28H,7-12,14H2