tert-butyl-[3-[(3-methyl-1H-indol-4-yl)oxy]-2-(phenylcarbonyloxy)propyl]azanium

Systemtic Name: tert-butyl-[3-[(3-methyl-1H-indol-4-yl)oxy]-2-(phenylcarbonyloxy)propyl]azanium Openeye Name: [2-benzoyloxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-tert-butyl-ammonium CAS Name: [2-benzoyloxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-tert-butylammonium IUPAC Name: [2-benzoyloxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-tert-butylazanium Traditional Name: [2-benzoyloxy-3-[(3-methyl-1H-indol-4-yl)oxy]propyl]-tert-butyl-ammonium Formula: C23H29N2O3+ MolecularWeight: 381.48796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=CC=C2)OCC(C[NH2+]C(C)(C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CNC2=C1C(=CC=C2)OCC(C[NH2+]C(C)(C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-16-13-24-19-11-8-12-20(21(16)19)27-15-18(14-25-23(2,3)4)28-22(26)17-9-6-5-7-10-17/h5-13,18,24-25H,14-15H2,1-4H3/p+1