6-chloranyl-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]-1-(phenylmethyl)quinoxalin-2-one

Systemtic Name: 6-chloranyl-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]-1-(phenylmethyl)quinoxalin-2-one Openeye Name: 1-benzyl-6-chloro-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinoxalin-2-one CAS Name: 6-chloro-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-1-(phenylmethyl)-2-quinoxalinone IUPAC Name: 1-benzyl-6-chloro-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinoxalin-2-one Traditional Name: 1-benzyl-6-chloro-3-[3-keto-3-(4-phenylpiperazino)propyl]quinoxalin-2-one Formula: C28H27ClN4O2 MolecularWeight: 486.99258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCC3=NC4=C(C=CC(=C4)Cl)N(C3=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCC3=NC4=C(C=CC(=C4)Cl)N(C3=O)CC5=CC=CC=C5

InChI

InChI=1S/C28H27ClN4O2/c29-22-11-13-26-25(19-22)30-24(28(35)33(26)20-21-7-3-1-4-8-21)12-14-27(34)32-17-15-31(16-18-32)23-9-5-2-6-10-23/h1-11,13,19H,12,14-18,20H2