3-bromanyl-4-ethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[4-(isovalerylamino)phenyl]benzamide Formula: C20H23BrN2O3 MolecularWeight: 419.31222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)Br

InChI

InChI=1S/C20H23BrN2O3/c1-4-26-18-10-5-14(12-17(18)21)20(25)23-16-8-6-15(7-9-16)22-19(24)11-13(2)3/h5-10,12-13H,4,11H2,1-3H3,(H,22,24)(H,23,25)