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

Systemtic Name: methyl 1-[2-[[(1R)-1-naphthalen-1-ylethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[[(1R)-1-(1-naphthyl)ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[[(1R)-1-(1-naphthalenyl)ethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[(1R)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[[(1R)-1-(1-naphthyl)ethyl]amino]ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)NC(=O)C[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C21H26N2O3/c1-15(18-9-5-7-16-6-3-4-8-19(16)18)22-20(24)14-23-12-10-17(11-13-23)21(25)26-2/h3-9,15,17H,10-14H2,1-2H3,(H,22,24)/p+1/t15-/m1/s1