N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-2-(phenethylamino)butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-2-(phenethylamino)butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(phenethylamino)butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(phenethylamino)butanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-(phenethylamino)butanamide Traditional Name: 4-hydroxy-2-(phenethylamino)-N-veratryl-butyramide Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C(CCO)NCCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C(CCO)NCCC2=CC=CC=C2)OC

InChI

InChI=1S/C21H28N2O4/c1-26-19-9-8-17(14-20(19)27-2)15-23-21(25)18(11-13-24)22-12-10-16-6-4-3-5-7-16/h3-9,14,18,22,24H,10-13,15H2,1-2H3,(H,23,25)