1-[2-[[(1S)-1-naphthalen-2-ylethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[(1S)-1-naphthalen-2-ylethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[[(1S)-1-(2-naphthyl)ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[(1S)-1-(2-naphthalenyl)ethyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[(1S)-1-naphthalen-2-ylethyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[[(1S)-1-(2-naphthyl)ethyl]amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C[C@@H](C1=CC2=CC=CC=C2C=C1)NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H25N3O2/c1-14(17-7-6-15-4-2-3-5-18(15)12-17)22-19(24)13-23-10-8-16(9-11-23)20(21)25/h2-7,12,14,16H,8-11,13H2,1H3,(H2,21,25)(H,22,24)/p+1/t14-/m0/s1