(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CCCC3=CNC4=CC=CC=C43)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CCCC3=CNC4=CC=CC=C43)Cl

InChI

InChI=1S/C21H20ClNO4/c22-17-8-15-11-25-13-27-21(15)16(9-17)12-26-20(24)7-3-4-14-10-23-19-6-2-1-5-18(14)19/h1-2,5-6,8-10,23H,3-4,7,11-13H2