(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)CCCC3=CNC4=CC=CC=C43)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)CCCC3=CNC4=CC=CC=C43)Br

InChI

InChI=1S/C20H18BrNO4/c21-16-9-19-18(25-12-26-19)8-14(16)11-24-20(23)7-3-4-13-10-22-17-6-2-1-5-15(13)17/h1-2,5-6,8-10,22H,3-4,7,11-12H2