ethyl 1-[(1,2-dimethylindol-3-yl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(1,2-dimethylindol-3-yl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(1,2-dimethylindol-3-yl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(1,2-dimethyl-3-indolyl)methyl]-4-(2-methoxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1,2-dimethylindol-3-yl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-[(1,2-dimethylindol-3-yl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C22H33N2O3+ MolecularWeight: 373.50902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=C(N(C3=CC=CC=C32)C)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=C(N(C3=CC=CC=C32)C)C)CCOC

InChI

InChI=1S/C22H32N2O3/c1-5-27-21(25)22(12-15-26-4)10-13-24(14-11-22)16-19-17(2)23(3)20-9-7-6-8-18(19)20/h6-9H,5,10-16H2,1-4H3/p+1