ethyl 1-[2,3-bis(oxidanyl)propyl]-4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 1-[2,3-bis(oxidanyl)propyl]-4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 1-(2,3-dihydroxypropyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 1-(2,3-dihydroxypropyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,3-dihydroxypropyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methylindole-3-carboxylate Traditional Name: 4-(dimethylaminomethyl)-1-glyceryl-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN(C)C)CC(CO)O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN(C)C)CC(CO)O)C

InChI

InChI=1S/C18H26N2O5/c1-5-25-18(24)16-11(2)20(8-12(22)10-21)14-6-7-15(23)13(17(14)16)9-19(3)4/h6-7,12,21-23H,5,8-10H2,1-4H3