ethyl 1-(2,3-dihydro-1H-inden-2-yl)-4-phenethyl-piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(2,3-dihydro-1H-inden-2-yl)-4-phenethyl-piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-indan-2-yl-4-phenethyl-piperidin-1-ium-4-carboxylate CAS Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-phenethyl-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,3-dihydro-1H-inden-2-yl)-4-phenethylpiperidin-1-ium-4-carboxylate Traditional Name: 1-indan-2-yl-4-phenethyl-piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C25H32NO2+ MolecularWeight: 378.52708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)C2CC3=CC=CC=C3C2)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)C2CC3=CC=CC=C3C2)CCC4=CC=CC=C4

InChI

InChI=1S/C25H31NO2/c1-2-28-24(27)25(13-12-20-8-4-3-5-9-20)14-16-26(17-15-25)23-18-21-10-6-7-11-22(21)19-23/h3-11,23H,2,12-19H2,1H3/p+1