ethyl 3-[2-[(2R)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]ethanoylamino]-5-methoxy-1-methyl-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[(2R)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]ethanoylamino]-5-methoxy-1-methyl-indole-2-carboxylate Openeye Name: ethyl 3-[[2-[(2R)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1-methyl-indole-2-carboxylate CAS Name: 3-[[2-[(2R)-2-(2-hydroxyethyl)-1-piperidin-1-iumyl]-1-oxoethyl]amino]-5-methoxy-1-methyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(2R)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1-methylindole-2-carboxylate Traditional Name: 3-[[2-[(2R)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1-methyl-indole-2-carboxylic acid ethyl ester Formula: C22H32N3O5+ MolecularWeight: 418.50658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)OC)NC(=O)C[NH+]3CCCCC3CCO

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)OC)NC(=O)C[NH+]3CCCC[C@@H]3CCO

InChI

InChI=1S/C22H31N3O5/c1-4-30-22(28)21-20(17-13-16(29-3)8-9-18(17)24(21)2)23-19(27)14-25-11-6-5-7-15(25)10-12-26/h8-9,13,15,26H,4-7,10-12,14H2,1-3H3,(H,23,27)/p+1/t15-/m1/s1