4-[2-[[3-(4-acetamido-3-methyl-phenoxy)-2-oxidanyl-propyl]amino]ethoxy]benzamide

Systemtic Name: 4-[2-[[3-(4-acetamido-3-methyl-phenoxy)-2-oxidanyl-propyl]amino]ethoxy]benzamide Openeye Name: 4-[2-[[3-(4-acetamido-3-methyl-phenoxy)-2-hydroxy-propyl]amino]ethoxy]benzamide CAS Name: 4-[2-[[3-(4-acetamido-3-methylphenoxy)-2-hydroxypropyl]amino]ethoxy]benzamide IUPAC Name: 4-[2-[[3-(4-acetamido-3-methylphenoxy)-2-hydroxypropyl]amino]ethoxy]benzamide Traditional Name: 4-[2-[[3-(4-acetamido-3-methyl-phenoxy)-2-hydroxy-propyl]amino]ethoxy]benzamide Formula: C21H27N3O5 MolecularWeight: 401.45618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC=C(C=C2)C(=O)N)O)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC=C(C=C2)C(=O)N)O)NC(=O)C

InChI

InChI=1S/C21H27N3O5/c1-14-11-19(7-8-20(14)24-15(2)25)29-13-17(26)12-23-9-10-28-18-5-3-16(4-6-18)21(22)27/h3-8,11,17,23,26H,9-10,12-13H2,1-2H3,(H2,22,27)(H,24,25)