methyl 2-[(2R)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-1-[2-(1-naphthylamino)-2-oxo-ethyl]-3-oxo-piperazin-1-ium-2-yl]acetate CAS Name: 2-[(2R)-1-[2-(1-naphthalenylamino)-2-oxoethyl]-3-oxo-2-piperazin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-[2-(naphthalen-1-ylamino)-2-oxoethyl]-3-oxopiperazin-1-ium-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-1-[2-keto-2-(1-naphthylamino)ethyl]piperazin-1-ium-2-yl]acetic acid methyl ester Formula: C19H22N3O4+ MolecularWeight: 356.39568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCC[NH+]1CC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)C[C@@H]1C(=O)NCC[NH+]1CC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H21N3O4/c1-26-18(24)11-16-19(25)20-9-10-22(16)12-17(23)21-15-8-4-6-13-5-2-3-7-14(13)15/h2-8,16H,9-12H2,1H3,(H,20,25)(H,21,23)/p+1/t16-/m1/s1