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

Systemtic Name: 3-bromanyl-4-butoxy-N-(2-cyanoethyl)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-bromo-4-butoxy-N-(2-cyanoethyl)benzamide CAS Name: 3-bromo-4-butoxy-N-(2-cyanoethyl)-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-bromo-4-butoxy-N-(2-cyanoethyl)benzamide Traditional Name: N-benzyl-3-bromo-4-butoxy-N-(2-cyanoethyl)benzamide Formula: C21H23BrN2O2 MolecularWeight: 415.32352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N(CCC#N)CC2=CC=CC=C2)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N(CCC#N)CC2=CC=CC=C2)Br

InChI

InChI=1S/C21H23BrN2O2/c1-2-3-14-26-20-11-10-18(15-19(20)22)21(25)24(13-7-12-23)16-17-8-5-4-6-9-17/h4-6,8-11,15H,2-3,7,13-14,16H2,1H3