5-(4-bromophenyl)-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]pentanamide

Systemtic Name: 5-(4-bromophenyl)-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]pentanamide Openeye Name: 5-(4-bromophenyl)-N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]pentanamide CAS Name: 5-(4-bromophenyl)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]pentanamide IUPAC Name: 5-(4-bromophenyl)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]pentanamide Traditional Name: 5-(4-bromophenyl)-N-[2-(2,6-dimethylanilino)-2-keto-ethyl]valeramide Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)CCCCC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)CCCCC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H25BrN2O2/c1-15-6-5-7-16(2)21(15)24-20(26)14-23-19(25)9-4-3-8-17-10-12-18(22)13-11-17/h5-7,10-13H,3-4,8-9,14H2,1-2H3,(H,23,25)(H,24,26)