(E)-3-(4-methoxy-3-oxidanyl-phenyl)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-methoxy-3-oxidanyl-phenyl)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(3-hydroxy-4-methoxy-phenyl)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]prop-2-en-1-one CAS Name: (E)-3-(3-hydroxy-4-methoxyphenyl)-1-[4-methoxy-3-(1-piperidin-1-iumylmethyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(3-hydroxy-4-methoxyphenyl)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(3-hydroxy-4-methoxy-phenyl)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]prop-2-en-1-one Formula: C23H28NO4+ MolecularWeight: 382.47272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OC)O)C[NH+]3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OC)O)C[NH+]3CCCCC3

InChI

InChI=1S/C23H27NO4/c1-27-22-11-8-18(15-19(22)16-24-12-4-3-5-13-24)20(25)9-6-17-7-10-23(28-2)21(26)14-17/h6-11,14-15,26H,3-5,12-13,16H2,1-2H3/p+1/b9-6+