(E)-1-(5-bromanyl-2-ethoxy-phenyl)-3-(4-piperidin-1-ylpiperidin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-bromanyl-2-ethoxy-phenyl)-3-(4-piperidin-1-ylpiperidin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-bromo-2-ethoxy-phenyl)-3-[4-(1-piperidyl)-1-piperidyl]prop-2-en-1-one CAS Name: (E)-1-(5-bromo-2-ethoxyphenyl)-3-[4-(1-piperidinyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-1-(5-bromo-2-ethoxyphenyl)-3-(4-piperidin-1-ylpiperidin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(5-bromo-2-ethoxy-phenyl)-3-(4-piperidinopiperidino)prop-2-en-1-one Formula: C21H29BrN2O2 MolecularWeight: 421.37116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)C=CN2CCC(CC2)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)/C=C/N2CCC(CC2)N3CCCCC3

InChI

InChI=1S/C21H29BrN2O2/c1-2-26-21-7-6-17(22)16-19(21)20(25)10-15-23-13-8-18(9-14-23)24-11-4-3-5-12-24/h6-7,10,15-16,18H,2-5,8-9,11-14H2,1H3/b15-10+