N-[4-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide

Systemtic Name: N-[4-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide Openeye Name: N-[3-acetyl-4-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethoxy]phenyl]butanamide CAS Name: N-[3-acetyl-4-[2-(4-bromo-2-methylanilino)-2-oxoethoxy]phenyl]butanamide IUPAC Name: N-[3-acetyl-4-[2-(4-bromo-2-methylanilino)-2-oxoethoxy]phenyl]butanamide Traditional Name: N-[3-acetyl-4-[2-(4-bromo-2-methyl-anilino)-2-keto-ethoxy]phenyl]butyramide Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC2=C(C=C(C=C2)Br)C)C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC2=C(C=C(C=C2)Br)C)C(=O)C

InChI

InChI=1S/C21H23BrN2O4/c1-4-5-20(26)23-16-7-9-19(17(11-16)14(3)25)28-12-21(27)24-18-8-6-15(22)10-13(18)2/h6-11H,4-5,12H2,1-3H3,(H,23,26)(H,24,27)