2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-N-(1H-indol-4-yl)benzamide

Systemtic Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-N-(1H-indol-4-yl)benzamide Openeye Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]-N-(1H-indol-4-yl)benzamide CAS Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-N-(1H-indol-4-yl)benzamide IUPAC Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-N-(1H-indol-4-yl)benzamide Traditional Name: 2-[3-(homoveratrylamino)-2-hydroxy-propoxy]-N-(1H-indol-4-yl)benzamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2C(=O)NC3=CC=CC4=C3C=CN4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=CC=CC=C2C(=O)NC3=CC=CC4=C3C=CN4)O)OC

InChI

InChI=1S/C28H31N3O5/c1-34-26-11-10-19(16-27(26)35-2)12-14-29-17-20(32)18-36-25-9-4-3-6-22(25)28(33)31-24-8-5-7-23-21(24)13-15-30-23/h3-11,13,15-16,20,29-30,32H,12,14,17-18H2,1-2H3,(H,31,33)