7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-8-nitro-chromen-2-one

Systemtic Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methyl-8-nitro-chromen-2-one Openeye Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-4-methyl-8-nitro-chromen-2-one CAS Name: 7-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-4-methyl-8-nitro-1-benzopyran-2-one IUPAC Name: 7-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-4-methyl-8-nitrochromen-2-one Traditional Name: 7-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-4-methyl-8-nitro-coumarin Formula: C23H22ClN3O6 MolecularWeight: 471.89028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2[N+](=O)[O-])OCC(=O)N3CCN(CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2[N+](=O)[O-])OCC(=O)N3CCN(CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN3O6/c1-15-12-21(29)33-23-18(15)6-7-19(22(23)27(30)31)32-14-20(28)26-10-8-25(9-11-26)13-16-2-4-17(24)5-3-16/h2-7,12H,8-11,13-14H2,1H3