(E)-3-(2-bromanyl-4-methyl-phenyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromanyl-4-methyl-phenyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(2-bromo-4-methyl-phenyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2-bromo-4-methylphenyl)-1-[4-(2-hydroxyethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2-bromo-4-methylphenyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(2-bromo-4-methyl-phenyl)-1-[4-(2-hydroxyethyl)piperazino]prop-2-en-1-one Formula: C16H21BrN2O2 MolecularWeight: 353.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(=O)N2CCN(CC2)CCO)Br

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(=O)N2CCN(CC2)CCO)Br

InChI

InChI=1S/C16H21BrN2O2/c1-13-2-3-14(15(17)12-13)4-5-16(21)19-8-6-18(7-9-19)10-11-20/h2-5,12,20H,6-11H2,1H3/b5-4+