2-chloranyl-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-1,4-naphthoquinone Formula: C27H22Cl2N2O2 MolecularWeight: 477.38178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H22Cl2N2O2/c28-20-12-10-19(11-13-20)24(18-6-2-1-3-7-18)30-14-16-31(17-15-30)25-23(29)26(32)21-8-4-5-9-22(21)27(25)33/h1-13,24H,14-17H2