4-[[5-(cyclohexylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[5-(cyclohexylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[5-(cyclohexylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[5-[(cyclohexylamino)-oxomethyl]-1-methyl-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[5-(cyclohexylcarbamoyl)-1-methylindol-3-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[5-(cyclohexylcarbamoyl)-1-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C(=O)NC3CCCCC3)CC4=C(C=C(C=C4)C(=O)O)OC

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)C(=O)NC3CCCCC3)CC4=C(C=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C25H28N2O4/c1-27-15-19(12-16-8-9-18(25(29)30)14-23(16)31-2)21-13-17(10-11-22(21)27)24(28)26-20-6-4-3-5-7-20/h8-11,13-15,20H,3-7,12H2,1-2H3,(H,26,28)(H,29,30)