6-chloranyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 6-chloranyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 6-[4-(4-acetylphenyl)piperazin-1-yl]-7-chloro-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 6-[4-(4-acetylphenyl)-1-piperazinyl]-7-chloro-5,8-dihydroxynaphthalene-1,4-dione IUPAC Name: 6-[4-(4-acetylphenyl)piperazin-1-yl]-7-chloro-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 6-[4-(4-acetylphenyl)piperazino]-7-chloro-5,8-dihydroxy-1,4-naphthoquinone Formula: C22H19ClN2O5 MolecularWeight: 426.84966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C4=C(C(=O)C=CC4=O)C(=C3Cl)O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C4=C(C(=O)C=CC4=O)C(=C3Cl)O)O

InChI

InChI=1S/C22H19ClN2O5/c1-12(26)13-2-4-14(5-3-13)24-8-10-25(11-9-24)20-19(23)21(29)17-15(27)6-7-16(28)18(17)22(20)30/h2-7,29-30H,8-11H2,1H3