(4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-(1H-indol-3-yl)propanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-(1H-indol-3-yl)propanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C24H29NO2 MolecularWeight: 363.49256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)CCC2=CNC3=CC=CC=C32)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)CCC2=CNC3=CC=CC=C32)C)C(C)(C)C

InChI

InChI=1S/C24H29NO2/c1-16-12-19(24(3,4)5)13-17(2)21(16)15-27-23(26)11-10-18-14-25-22-9-7-6-8-20(18)22/h6-9,12-14,25H,10-11,15H2,1-5H3