5-(2,3-dimethylbutyl)-1-[(4-propan-2-ylphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 5-(2,3-dimethylbutyl)-1-[(4-propan-2-ylphenyl)methyl]indole-2-carboxylic acid Openeye Name: 5-(2,3-dimethylbutyl)-1-[(4-isopropylphenyl)methyl]indole-2-carboxylic acid CAS Name: 5-(2,3-dimethylbutyl)-1-[(4-propan-2-ylphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 5-(2,3-dimethylbutyl)-1-[(4-propan-2-ylphenyl)methyl]indole-2-carboxylic acid Traditional Name: 5-(2,3-dimethylbutyl)-1-(4-isopropylbenzyl)indole-2-carboxylic acid Formula: C25H31NO2 MolecularWeight: 377.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)CC(C)C(C)C)C=C2C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)CC(C)C(C)C)C=C2C(=O)O

InChI

InChI=1S/C25H31NO2/c1-16(2)18(5)12-20-8-11-23-22(13-20)14-24(25(27)28)26(23)15-19-6-9-21(10-7-19)17(3)4/h6-11,13-14,16-18H,12,15H2,1-5H3,(H,27,28)