1-[(4-carboxyphenyl)methyl]-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid

Systemtic Name: 1-[(4-carboxyphenyl)methyl]-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid Openeye Name: 1-[(4-carboxyphenyl)methyl]-3-cyclohexyl-2-(3-furyl)indole-6-carboxylic acid CAS Name: 1-[(4-carboxyphenyl)methyl]-3-cyclohexyl-2-(3-furanyl)-6-indolecarboxylic acid IUPAC Name: 1-[(4-carboxyphenyl)methyl]-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid Traditional Name: 1-(4-carboxybenzyl)-3-cyclohexyl-2-(3-furyl)indole-6-carboxylic acid Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC4=CC=C(C=C4)C(=O)O)C5=COC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC4=CC=C(C=C4)C(=O)O)C5=COC=C5

InChI

InChI=1S/C27H25NO5/c29-26(30)19-8-6-17(7-9-19)15-28-23-14-20(27(31)32)10-11-22(23)24(18-4-2-1-3-5-18)25(28)21-12-13-33-16-21/h6-14,16,18H,1-5,15H2,(H,29,30)(H,31,32)