2-[3-cyclohexyl-2-(furan-3-yl)-6-methoxycarbonyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-cyclohexyl-2-(furan-3-yl)-6-methoxycarbonyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-cyclohexyl-2-(3-furyl)-6-methoxycarbonyl-indol-1-yl]acetic acid CAS Name: 2-[3-cyclohexyl-2-(3-furanyl)-6-methoxycarbonyl-1-indolyl]acetic acid IUPAC Name: 2-[3-cyclohexyl-2-(furan-3-yl)-6-methoxycarbonylindol-1-yl]acetic acid Traditional Name: 2-[6-carbomethoxy-3-cyclohexyl-2-(3-furyl)indol-1-yl]acetic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C(N2CC(=O)O)C3=COC=C3)C4CCCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C(N2CC(=O)O)C3=COC=C3)C4CCCCC4

InChI

InChI=1S/C22H23NO5/c1-27-22(26)15-7-8-17-18(11-15)23(12-19(24)25)21(16-9-10-28-13-16)20(17)14-5-3-2-4-6-14/h7-11,13-14H,2-6,12H2,1H3,(H,24,25)