2-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-4-oxidanyl-3-pentoxy-benzamide

Systemtic Name: 2-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-4-oxidanyl-3-pentoxy-benzamide Openeye Name: 4-hydroxy-2-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]-3-pentoxy-benzamide CAS Name: 4-hydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-3-pentoxybenzamide IUPAC Name: 4-hydroxy-2-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-3-pentoxybenzamide Traditional Name: 3-amoxy-2-homovanillyl-4-hydroxy-benzamide Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1CCC2=CC(=C(C=C2)O)OC)C(=O)N)O

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1CCC2=CC(=C(C=C2)O)OC)C(=O)N)O

InChI

InChI=1S/C21H27NO5/c1-3-4-5-12-27-20-15(16(21(22)25)9-11-18(20)24)8-6-14-7-10-17(23)19(13-14)26-2/h7,9-11,13,23-24H,3-6,8,12H2,1-2H3,(H2,22,25)