5-[2-[4-(3,4-dimethoxyphenyl)butan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-benzamide

Systemtic Name: 5-[2-[4-(3,4-dimethoxyphenyl)butan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-benzamide Openeye Name: 5-[2-[[3-(3,4-dimethoxyphenyl)-1-methyl-propyl]amino]-1-hydroxy-ethyl]-2-hydroxy-benzamide CAS Name: 5-[2-[4-(3,4-dimethoxyphenyl)butan-2-ylamino]-1-hydroxyethyl]-2-hydroxybenzamide IUPAC Name: 5-[2-[4-(3,4-dimethoxyphenyl)butan-2-ylamino]-1-hydroxyethyl]-2-hydroxybenzamide Traditional Name: 5-[2-[[3-(3,4-dimethoxyphenyl)-1-methyl-propyl]amino]-1-hydroxy-ethyl]-2-hydroxy-benzamide Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=C(C=C1)OC)OC)NCC(C2=CC(=C(C=C2)O)C(=O)N)O

Isomeric SMILES

CC(CCC1=CC(=C(C=C1)OC)OC)NCC(C2=CC(=C(C=C2)O)C(=O)N)O

InChI

InChI=1S/C21H28N2O5/c1-13(4-5-14-6-9-19(27-2)20(10-14)28-3)23-12-18(25)15-7-8-17(24)16(11-15)21(22)26/h6-11,13,18,23-25H,4-5,12H2,1-3H3,(H2,22,26)