ethyl (3S)-1-[[(4R)-4-methyl-4-naphthalen-1-yl-2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[(4R)-4-methyl-4-naphthalen-1-yl-2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[[(4R)-4-methyl-4-(1-naphthyl)-2,5-dioxo-imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[[(4R)-4-methyl-4-(1-naphthalenyl)-2,5-dioxo-1-imidazolidinyl]methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[[(4R)-2,5-diketo-4-methyl-4-(1-naphthyl)imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CN2C(=O)C(NC2=O)(C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)[C@H]1CCC[NH+](C1)CN2C(=O)[C@@](NC2=O)(C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O4/c1-3-30-20(27)17-10-7-13-25(14-17)15-26-21(28)23(2,24-22(26)29)19-12-6-9-16-8-4-5-11-18(16)19/h4-6,8-9,11-12,17H,3,7,10,13-15H2,1-2H3,(H,24,29)/p+1/t17-,23+/m0/s1