(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-benzoyl-1-piperidyl)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-benzoyl-1-piperidinyl)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-benzoylpiperidin-1-yl)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-benzoylpiperidino)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-en-1-one Formula: C25H28ClNO4 MolecularWeight: 441.94712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCC(CC2)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C25H28ClNO4/c1-17(2)31-25-21(26)15-18(16-22(25)30-3)9-10-23(28)27-13-11-20(12-14-27)24(29)19-7-5-4-6-8-19/h4-10,15-17,20H,11-14H2,1-3H3/b10-9+