3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-6-nitro-chromen-2-one

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-6-nitro-chromen-2-one Openeye Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-nitro-chromen-2-one CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-nitrochromen-2-one Traditional Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-nitro-coumarin Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C20H16ClN3O5/c21-14-2-1-3-15(12-14)22-6-8-23(9-7-22)19(25)17-11-13-10-16(24(27)28)4-5-18(13)29-20(17)26/h1-5,10-12H,6-9H2