N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(2-cyanoethanoylamino)-N-methyl-benzamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(2-cyanoethanoylamino)-N-methyl-benzamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-4-[(2-cyanoacetyl)amino]-N-methyl-benzamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(2-cyano-1-oxoethyl)amino]-N-methylbenzamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(2-cyanoacetyl)amino]-N-methylbenzamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-[(2-cyanoacetyl)amino]-N-methyl-benzamide Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C19H18BrN3O3/c1-23(12-14-11-15(20)5-8-17(14)26-2)19(25)13-3-6-16(7-4-13)22-18(24)9-10-21/h3-8,11H,9,12H2,1-2H3,(H,22,24)