2-(tert-butylamino)-1-(1H-indol-3-yl)propan-1-one hydrate hydrochloride

Systemtic Name: 2-(tert-butylamino)-1-(1H-indol-3-yl)propan-1-one hydrate hydrochloride Openeye Name: 2-(tert-butylamino)-1-(1H-indol-3-yl)propan-1-one hydrate hydrochloride CAS Name: 2-(tert-butylamino)-1-(1H-indol-3-yl)-1-propanone hydrate hydrochloride IUPAC Name: 2-(tert-butylamino)-1-(1H-indol-3-yl)propan-1-one hydrate hydrochloride Traditional Name: 2-(tert-butylamino)-1-(1H-indol-3-yl)propan-1-one hydrate hydrochloride Formula: C15H23ClN2O2 MolecularWeight: 298.80832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)NC(C)(C)C.O.Cl

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)NC(C)(C)C.O.Cl

InChI

InChI=1S/C15H20N2O.ClH.H2O/c1-10(17-15(2,3)4)14(18)12-9-16-13-8-6-5-7-11(12)13;;/h5-10,16-17H,1-4H3;1H;1H2