1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)-7-methyl-indole-6-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)-7-methyl-indole-6-carboxylic acid Openeye Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furyl)-7-methyl-indole-6-carboxylic acid CAS Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furanyl)-7-methyl-6-indolecarboxylic acid IUPAC Name: 1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)-7-methylindole-6-carboxylic acid Traditional Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furyl)-7-methyl-indole-6-carboxylic acid Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=C2C3CCCCC3)C4=COC=C4)CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=C2C3CCCCC3)C4=COC=C4)CC(=O)O)C(=O)O

InChI

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