ethyl 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-carboxylate CAS Name: 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxylate Traditional Name: 4-(2-methoxyethyl)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C21H32NO3+ MolecularWeight: 346.48368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO3/c1-4-25-20(23)21(12-15-24-3)10-13-22(14-11-21)17-18(2)16-19-8-6-5-7-9-19/h5-9,16H,4,10-15,17H2,1-3H3/p+1/b18-16+