methyl 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-[[(1R)-1,2-diphenylethyl]amino]-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC(=O)N[C@H](CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-28-23(27)20-12-14-25(15-13-20)17-22(26)24-21(19-10-6-3-7-11-19)16-18-8-4-2-5-9-18/h2-11,20-21H,12-17H2,1H3,(H,24,26)/p+1/t21-/m1/s1