ethyl 1-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 1-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-1-(2-methoxy-2-oxo-ethyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate CAS Name: 5-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-4-(4-morpholin-4-iumylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate Traditional Name: 5-hydroxy-1-(2-keto-2-methoxy-ethyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylic acid ethyl ester Formula: C20H27N2O6+ MolecularWeight: 391.43818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+]3CCOCC3)CC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+]3CCOCC3)CC(=O)OC)C

InChI

InChI=1S/C20H26N2O6/c1-4-28-20(25)18-13(2)22(12-17(24)26-3)15-5-6-16(23)14(19(15)18)11-21-7-9-27-10-8-21/h5-6,23H,4,7-12H2,1-3H3/p+1