1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxybutanoyl)-2-propyl-indole-6-carboxamide

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxybutanoyl)-2-propyl-indole-6-carboxamide Openeye Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxybutanoyl)-2-propyl-indole-6-carboxamide CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxy-1-oxobutyl)-2-propyl-6-indolecarboxamide IUPAC Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxybutanoyl)-2-propylindole-6-carboxamide Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-(3-methoxybutanoyl)-2-propyl-indole-6-carboxamide Formula: C25H27ClN2O5 MolecularWeight: 470.94528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=C(C=C2)C(=O)N)C(=O)CC(C)OC

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=C(C=C2)C(=O)N)C(=O)CC(C)OC

InChI

InChI=1S/C25H27ClN2O5/c1-4-5-19-24(21(29)8-14(2)31-3)17-7-6-15(25(27)30)9-20(17)28(19)12-16-10-22-23(11-18(16)26)33-13-32-22/h6-7,9-11,14H,4-5,8,12-13H2,1-3H3,(H2,27,30)