1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-(4-ethoxyphenyl)butane-1,4-dione IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-4-p-phenetyl-butane-1,4-dione Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C23H27ClN2O3/c1-3-29-20-8-5-18(6-9-20)22(27)10-11-23(28)26-14-12-25(13-15-26)21-16-19(24)7-4-17(21)2/h4-9,16H,3,10-15H2,1-2H3