3-bromanyl-4-ethoxy-5-methoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-5-methoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide Openeye Name: 3-bromo-4-ethoxy-5-methoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide CAS Name: 3-bromo-4-ethoxy-5-methoxy-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-5-methoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[3-(isobutyrylamino)benzyl]-5-methoxy-benzamide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)OC

InChI

InChI=1S/C21H25BrN2O4/c1-5-28-19-17(22)10-15(11-18(19)27-4)21(26)23-12-14-7-6-8-16(9-14)24-20(25)13(2)3/h6-11,13H,5,12H2,1-4H3,(H,23,26)(H,24,25)