(2E,4E)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-[4-(5-chloro-2-methyl-phenyl)piperazino]hexa-2,4-dien-1-one Formula: C17H21ClN2O MolecularWeight: 304.81444

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

Isomeric SMILES

C/C=C/C=C/C(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C17H21ClN2O/c1-3-4-5-6-17(21)20-11-9-19(10-12-20)16-13-15(18)8-7-14(16)2/h3-8,13H,9-12H2,1-2H3/b4-3+,6-5+