2-chloranyl-3-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-yl]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-(3,4-dichlorobenzoyl)piperazino]-1,4-naphthoquinone Formula: C21H15Cl3N2O3 MolecularWeight: 449.7144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H15Cl3N2O3/c22-15-6-5-12(11-16(15)23)21(29)26-9-7-25(8-10-26)18-17(24)19(27)13-3-1-2-4-14(13)20(18)28/h1-6,11H,7-10H2