(2S)-2-(deuterioamino)-2-methyl-3-(4-methyl-2-oxidanylidene-1H-quinolin-6-yl)propanoic acid

Systemtic Name: (2S)-2-(deuterioamino)-2-methyl-3-(4-methyl-2-oxidanylidene-1H-quinolin-6-yl)propanoic acid Openeye Name: (2S)-2-(deuterioamino)-2-methyl-3-(4-methyl-2-oxo-1H-quinolin-6-yl)propanoic acid CAS Name: (2S)-2-(deuterioamino)-2-methyl-3-(4-methyl-2-oxo-1H-quinolin-6-yl)propanoic acid IUPAC Name: (2S)-2-(deuterioamino)-2-methyl-3-(4-methyl-2-oxo-1H-quinolin-6-yl)propanoic acid Traditional Name: (2S)-2-(deuterioamino)-3-(2-keto-4-methyl-1H-quinolin-6-yl)-2-methyl-propionic acid Formula: C14H16N2O3 MolecularWeight: 261.294602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC2=C1C=C(C=C2)CC(C)(C(=O)O)N

Isomeric SMILES

[2H]N[C@@](C)(CC1=CC2=C(C=C1)NC(=O)C=C2C)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-8-5-12(17)16-11-4-3-9(6-10(8)11)7-14(2,15)13(18)19/h3-6H,7,15H2,1-2H3,(H,16,17)(H,18,19)/t14-/m0/s1/i/hD