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2-[2-methyl-1-(4-non-3-ynoxyphenyl)carbonyl-indol-4-yl]ethanoic acid
2-[2-methyl-1-(4-non-3-ynoxyphenyl)carbonyl-indol-4-yl]ethanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCC#CCCOC1=CC=C(C=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C
Isomeric SMILES
CCCCCC#CCCOC1=CC=C(C=C1)C(=O)N2C(=CC3=C(C=CC=C32)CC(=O)O)C
InChI
InChI=1S/C27H29NO4/c1-3-4-5-6-7-8-9-17-32-23-15-13-21(14-16-23)27(31)28-20(2)18-24-22(19-26(29)30)11-10-12-25(24)28/h10-16,18H,3-6,9,17,19H2,1-2H3,(H,29,30)
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