ethyl 4-(1,3-benzodioxol-5-ylcarbonylamino)-5-methoxy-1,2-dimethyl-indole-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylcarbonylamino)-5-methoxy-1,2-dimethyl-indole-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxole-5-carbonylamino)-5-methoxy-1,2-dimethyl-indole-3-carboxylate CAS Name: 4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-5-methoxy-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxole-5-carbonylamino)-5-methoxy-1,2-dimethylindole-3-carboxylate Traditional Name: 5-methoxy-1,2-dimethyl-4-(piperonyloylamino)indole-3-carboxylic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)C3=CC4=C(C=C3)OCO4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)C3=CC4=C(C=C3)OCO4)C)C

InChI

InChI=1S/C22H22N2O6/c1-5-28-22(26)18-12(2)24(3)14-7-9-16(27-4)20(19(14)18)23-21(25)13-6-8-15-17(10-13)30-11-29-15/h6-10H,5,11H2,1-4H3,(H,23,25)