tert-butyl 2-butyl-3-(hydroxymethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 2-butyl-3-(hydroxymethyl)indole-1-carboxylate Openeye Name: tert-butyl 2-butyl-3-(hydroxymethyl)indole-1-carboxylate CAS Name: 2-butyl-3-(hydroxymethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-butyl-3-(hydroxymethyl)indole-1-carboxylate Traditional Name: 2-butyl-3-methylol-indole-1-carboxylic acid tert-butyl ester Formula: C18H25NO3 MolecularWeight: 303.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)CO

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C18H25NO3/c1-5-6-10-16-14(12-20)13-9-7-8-11-15(13)19(16)17(21)22-18(2,3)4/h7-9,11,20H,5-6,10,12H2,1-4H3