ethyl 3-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanoylamino]-5,6-dimethoxy-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanoylamino]-5,6-dimethoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanoylamino]-5,6-dimethoxy-1H-indole-2-carboxylate CAS Name: 3-[[3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-1-oxopropyl]amino]-5,6-dimethoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanoylamino]-5,6-dimethoxy-1H-indole-2-carboxylate Traditional Name: 3-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanoylamino]-5,6-dimethoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C23H34N3O5+ MolecularWeight: 432.53316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CC[NH+]3CC(CC(C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CC[NH+]3C[C@@H](C[C@H](C3)C)C

InChI

InChI=1S/C23H33N3O5/c1-6-31-23(28)22-21(16-10-18(29-4)19(30-5)11-17(16)24-22)25-20(27)7-8-26-12-14(2)9-15(3)13-26/h10-11,14-15,24H,6-9,12-13H2,1-5H3,(H,25,27)/p+1/t14-,15-/m1/s1