ethyl 6-(3,4-dimethylphenyl)-1-(furan-2-ylmethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 6-(3,4-dimethylphenyl)-1-(furan-2-ylmethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-(3,4-dimethylphenyl)-1-(2-furylmethyl)-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 6-(3,4-dimethylphenyl)-1-(2-furanylmethyl)-5-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(3,4-dimethylphenyl)-1-(furan-2-ylmethyl)-5-hydroxy-2-methylindole-3-carboxylate Traditional Name: 6-(3,4-dimethylphenyl)-1-(2-furfuryl)-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)C3=CC(=C(C=C3)C)C)CC4=CC=CO4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)O)C3=CC(=C(C=C3)C)C)CC4=CC=CO4)C

InChI

InChI=1S/C25H25NO4/c1-5-29-25(28)24-17(4)26(14-19-7-6-10-30-19)22-12-20(23(27)13-21(22)24)18-9-8-15(2)16(3)11-18/h6-13,27H,5,14H2,1-4H3