ethyl 1-[(2,5-dimethylphenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2,5-dimethylphenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(2,5-dimethylphenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-(2-methoxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,5-dimethylphenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(2,5-dimethylbenzyl)-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C20H32NO3+ MolecularWeight: 334.47298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=C(C=CC(=C2)C)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=C(C=CC(=C2)C)C)CCOC

InChI

InChI=1S/C20H31NO3/c1-5-24-19(22)20(10-13-23-4)8-11-21(12-9-20)15-18-14-16(2)6-7-17(18)3/h6-7,14H,5,8-13,15H2,1-4H3/p+1