ethyl 3-(1,3-benzodioxol-5-yl)-1-[[2-(2-ethoxy-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]methyl]-5-oxidanyl-indole-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzodioxol-5-yl)-1-[[2-(2-ethoxy-2-oxidanylidene-ethoxy)-4-methoxy-phenyl]methyl]-5-oxidanyl-indole-2-carboxylate Openeye Name: ethyl 3-(1,3-benzodioxol-5-yl)-1-[[2-(2-ethoxy-2-oxo-ethoxy)-4-methoxy-phenyl]methyl]-5-hydroxy-indole-2-carboxylate CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[[2-(2-ethoxy-2-oxoethoxy)-4-methoxyphenyl]methyl]-5-hydroxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzodioxol-5-yl)-1-[[2-(2-ethoxy-2-oxoethoxy)-4-methoxyphenyl]methyl]-5-hydroxyindole-2-carboxylate Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(2-ethoxy-2-keto-ethoxy)-4-methoxy-benzyl]-5-hydroxy-indole-2-carboxylic acid ethyl ester Formula: C30H29NO9 MolecularWeight: 547.55256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=CC(=C1)OC)CN2C3=C(C=C(C=C3)O)C(=C2C(=O)OCC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC(=O)COC1=C(C=CC(=C1)OC)CN2C3=C(C=C(C=C3)O)C(=C2C(=O)OCC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H29NO9/c1-4-36-27(33)16-38-25-14-21(35-3)9-6-19(25)15-31-23-10-8-20(32)13-22(23)28(29(31)30(34)37-5-2)18-7-11-24-26(12-18)40-17-39-24/h6-14,32H,4-5,15-17H2,1-3H3