ethyl 4-[2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanoylamino]-5-methoxy-1,2-dimethyl-indole-3-carboxylate

Systemtic Name: ethyl 4-[2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanoylamino]-5-methoxy-1,2-dimethyl-indole-3-carboxylate Openeye Name: ethyl 4-[[2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1,2-dimethyl-indole-3-carboxylate CAS Name: 4-[[2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]-5-methoxy-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate Traditional Name: 4-[[2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetyl]amino]-5-methoxy-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C23H34N3O4+ MolecularWeight: 416.53376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)NC2=C(C=CC3=C2C(=C(N3C)C)C(=O)OCC)OC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC(=O)NC2=C(C=CC3=C2C(=C(N3C)C)C(=O)OCC)OC

InChI

InChI=1S/C23H33N3O4/c1-6-16-10-8-9-13-26(16)14-19(27)24-22-18(29-5)12-11-17-21(22)20(15(3)25(17)4)23(28)30-7-2/h11-12,16H,6-10,13-14H2,1-5H3,(H,24,27)/p+1/t16-/m0/s1