tert-butyl 4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H38N3O4+ MolecularWeight: 432.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H37N3O4/c1-18-5-7-19(8-6-18)21(17-26-13-15-30-16-14-26)25-22(28)20-9-11-27(12-10-20)23(29)31-24(2,3)4/h5-8,20-21H,9-17H2,1-4H3,(H,25,28)/p+1/t21-/m0/s1