3-bromanyl-N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-prop-2-enoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4-butoxy-3-methoxy-phenyl)methyl]-4-prop-2-enoxy-benzamide Openeye Name: 4-allyloxy-3-bromo-N-[(4-butoxy-3-methoxy-phenyl)methyl]benzamide CAS Name: 3-bromo-N-[(4-butoxy-3-methoxyphenyl)methyl]-4-prop-2-enoxybenzamide IUPAC Name: 3-bromo-N-[(4-butoxy-3-methoxyphenyl)methyl]-4-prop-2-enoxybenzamide Traditional Name: 4-allyloxy-3-bromo-N-(4-butoxy-3-methoxy-benzyl)benzamide Formula: C22H26BrNO4 MolecularWeight: 448.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OCC=C)Br)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OCC=C)Br)OC

InChI

InChI=1S/C22H26BrNO4/c1-4-6-12-28-20-9-7-16(13-21(20)26-3)15-24-22(25)17-8-10-19(18(23)14-17)27-11-5-2/h5,7-10,13-14H,2,4,6,11-12,15H2,1,3H3,(H,24,25)