methyl 3-(6-oxidanylhexyl)-5-(5-oxidanylpentoxy)-1H-indole-2-carboxylate

Systemtic Name: methyl 3-(6-oxidanylhexyl)-5-(5-oxidanylpentoxy)-1H-indole-2-carboxylate Openeye Name: methyl 3-(6-hydroxyhexyl)-5-(5-hydroxypentoxy)-1H-indole-2-carboxylate CAS Name: 3-(6-hydroxyhexyl)-5-(5-hydroxypentoxy)-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(6-hydroxyhexyl)-5-(5-hydroxypentoxy)-1H-indole-2-carboxylate Traditional Name: 3-(6-hydroxyhexyl)-5-(5-hydroxypentoxy)-1H-indole-2-carboxylic acid methyl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1)C=CC(=C2)OCCCCCO)CCCCCCO

Isomeric SMILES

COC(=O)C1=C(C2=C(N1)C=CC(=C2)OCCCCCO)CCCCCCO

InChI

InChI=1S/C21H31NO5/c1-26-21(25)20-17(9-5-2-3-6-12-23)18-15-16(10-11-19(18)22-20)27-14-8-4-7-13-24/h10-11,15,22-24H,2-9,12-14H2,1H3