3-cyclohexyl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-cyclohexyl-1-[(3,5-dimethylisoxazol-4-yl)methyl]indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[(3,5-dimethyl-4-isoxazolyl)methyl]-2-(4-phenylmethoxyphenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-cyclohexyl-1-[(3,5-dimethylisoxazol-4-yl)methyl]indole-6-carboxylic acid Formula: C34H34N2O4 MolecularWeight: 534.64476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6

InChI

InChI=1S/C34H34N2O4/c1-22-30(23(2)40-35-22)20-36-31-19-27(34(37)38)15-18-29(31)32(25-11-7-4-8-12-25)33(36)26-13-16-28(17-14-26)39-21-24-9-5-3-6-10-24/h3,5-6,9-10,13-19,25H,4,7-8,11-12,20-21H2,1-2H3,(H,37,38)