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

Systemtic Name: 2-chloranyl-3-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-(3-chlorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-(3-chlorobenzoyl)piperazin-1-yl]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-(3-chlorobenzoyl)piperazino]-1,4-naphthoquinone Formula: C21H16Cl2N2O3 MolecularWeight: 415.26934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16Cl2N2O3/c22-14-5-3-4-13(12-14)21(28)25-10-8-24(9-11-25)18-17(23)19(26)15-6-1-2-7-16(15)20(18)27/h1-7,12H,8-11H2