6,8-bis(chloranyl)-3-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6,8-bis(chloranyl)-3-[4-(3-chloranyl-4-methyl-phenyl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6,8-dichloro-3-[4-(3-chloro-4-methyl-phenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 6,8-dichloro-3-[[4-(3-chloro-4-methylphenyl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6,8-dichloro-3-[4-(3-chloro-4-methylphenyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 6,8-dichloro-3-[4-(3-chloro-4-methyl-phenyl)piperazine-1-carbonyl]coumarin Formula: C21H17Cl3N2O3 MolecularWeight: 451.73028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=CC(=CC(=C4OC3=O)Cl)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=CC(=CC(=C4OC3=O)Cl)Cl)Cl

InChI

InChI=1S/C21H17Cl3N2O3/c1-12-2-3-15(11-17(12)23)25-4-6-26(7-5-25)20(27)16-9-13-8-14(22)10-18(24)19(13)29-21(16)28/h2-3,8-11H,4-7H2,1H3