3-bromanyl-N-(2-cyanoethyl)-4-methyl-N-(phenylmethyl)benzamide

Systemtic Name: 3-bromanyl-N-(2-cyanoethyl)-4-methyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-bromo-N-(2-cyanoethyl)-4-methyl-benzamide CAS Name: 3-bromo-N-(2-cyanoethyl)-4-methyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-bromo-N-(2-cyanoethyl)-4-methylbenzamide Traditional Name: N-benzyl-3-bromo-N-(2-cyanoethyl)-4-methyl-benzamide Formula: C18H17BrN2O MolecularWeight: 357.24438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCC#N)CC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCC#N)CC2=CC=CC=C2)Br

InChI

InChI=1S/C18H17BrN2O/c1-14-8-9-16(12-17(14)19)18(22)21(11-5-10-20)13-15-6-3-2-4-7-15/h2-4,6-9,12H,5,11,13H2,1H3