N-[3-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]phenyl]butanamide

Systemtic Name: N-[3-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoylamino]phenyl]butanamide Openeye Name: N-[3-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]phenyl]butanamide CAS Name: N-[3-[[2-(4-bromo-2-propan-2-ylphenoxy)-1-oxoethyl]amino]phenyl]butanamide IUPAC Name: N-[3-[[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]amino]phenyl]butanamide Traditional Name: N-[3-[[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]phenyl]butyramide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)C

InChI

InChI=1S/C21H25BrN2O3/c1-4-6-20(25)23-16-7-5-8-17(12-16)24-21(26)13-27-19-10-9-15(22)11-18(19)14(2)3/h5,7-12,14H,4,6,13H2,1-3H3,(H,23,25)(H,24,26)