N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)-N-ethyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)-N-ethyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxy-phenyl)-N-ethyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)-N-ethylpropanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)-N-ethylpropanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-ethyl-N-piperonyl-propionamide Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H22BrNO4/c1-3-22(12-15-5-8-18-19(11-15)26-13-25-18)20(23)9-6-14-4-7-17(24-2)16(21)10-14/h4-5,7-8,10-11H,3,6,9,12-13H2,1-2H3