ethyl 5-methoxy-3-[2-(4-oxidanylidenepiperidin-1-ium-1-yl)ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-methoxy-3-[2-(4-oxidanylidenepiperidin-1-ium-1-yl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-methoxy-3-[[2-(4-oxopiperidin-1-ium-1-yl)acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-[[1-oxo-2-(4-oxo-1-piperidin-1-iumyl)ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-3-[[2-(4-oxopiperidin-1-ium-1-yl)acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 3-[[2-(4-ketopiperidin-1-ium-1-yl)acetyl]amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C19H24N3O5+ MolecularWeight: 374.41096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CCC(=O)CC3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)C[NH+]3CCC(=O)CC3

InChI

InChI=1S/C19H23N3O5/c1-3-27-19(25)18-17(14-10-13(26-2)4-5-15(14)20-18)21-16(24)11-22-8-6-12(23)7-9-22/h4-5,10,20H,3,6-9,11H2,1-2H3,(H,21,24)/p+1