3-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-(2-chloro-4-nitro-phenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2-chloro-4-nitro-phenyl)piperazine-1-carbonyl]coumarin Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C3=CC4=CC=CC=C4OC3=O

InChI

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