2-chloranyl-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1-piperidyl]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1-piperidinyl]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidino]-1,4-naphthoquinone Formula: C24H19Cl2N3O2 MolecularWeight: 452.33256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC(=NN2)C3=CC=C(C=C3)Cl)C4=C(C(=O)C5=CC=CC=C5C4=O)Cl

Isomeric SMILES

C1CN(CCC1C2=CC(=NN2)C3=CC=C(C=C3)Cl)C4=C(C(=O)C5=CC=CC=C5C4=O)Cl

InChI

InChI=1S/C24H19Cl2N3O2/c25-16-7-5-14(6-8-16)19-13-20(28-27-19)15-9-11-29(12-10-15)22-21(26)23(30)17-3-1-2-4-18(17)24(22)31/h1-8,13,15H,9-12H2,(H,27,28)