(E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]prop-2-en-1-one CAS Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[4-methoxy-3-(1-pyrrolidinylmethyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-[4-methoxy-3-(pyrrolidinomethyl)phenyl]prop-2-en-1-one Formula: C22H24ClNO4 MolecularWeight: 401.88326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)Cl)O)OC)CN3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC(=C(C(=C2)Cl)O)OC)CN3CCCC3

InChI

InChI=1S/C22H24ClNO4/c1-27-20-8-6-16(13-17(20)14-24-9-3-4-10-24)19(25)7-5-15-11-18(23)22(26)21(12-15)28-2/h5-8,11-13,26H,3-4,9-10,14H2,1-2H3/b7-5+