methyl 2-[(2R)-1-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-1-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-1-[[5-methyl-2-(2-naphthyl)oxazol-4-yl]methyl]-3-oxo-piperazin-1-ium-2-yl]acetate CAS Name: 2-[(2R)-1-[[5-methyl-2-(2-naphthalenyl)-4-oxazolyl]methyl]-3-oxo-2-piperazin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-[(5-methyl-2-naphthalen-2-yl-1,3-oxazol-4-yl)methyl]-3-oxopiperazin-1-ium-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-1-[[5-methyl-2-(2-naphthyl)oxazol-4-yl]methyl]piperazin-1-ium-2-yl]acetic acid methyl ester Formula: C22H24N3O4+ MolecularWeight: 394.44366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC3=CC=CC=C3C=C2)C[NH+]4CCNC(=O)C4CC(=O)OC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC3=CC=CC=C3C=C2)C[NH+]4CCNC(=O)[C@H]4CC(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-14-18(13-25-10-9-23-21(27)19(25)12-20(26)28-2)24-22(29-14)17-8-7-15-5-3-4-6-16(15)11-17/h3-8,11,19H,9-10,12-13H2,1-2H3,(H,23,27)/p+1/t19-/m1/s1