N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-bromophenyl)methyl]butanediamide

Systemtic Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-bromophenyl)methyl]butanediamide Openeye Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-bromophenyl)methyl]butanediamide CAS Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-bromophenyl)methyl]butanediamide IUPAC Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-bromophenyl)methyl]butanediamide Traditional Name: N-(3-bromobenzyl)-N'-piperonyl-succinamide Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC(=O)NCC3=CC(=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC(=O)NCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H19BrN2O4/c20-15-3-1-2-13(8-15)10-21-18(23)6-7-19(24)22-11-14-4-5-16-17(9-14)26-12-25-16/h1-5,8-9H,6-7,10-12H2,(H,21,23)(H,22,24)