(2S)-4-[(1R,2S)-2-methylcyclopropyl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: (2S)-4-[(1R,2S)-2-methylcyclopropyl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: (2S)-4-[(1R,2S)-2-methylcyclopropanecarbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: (2S)-4-[[(1R,2S)-2-methylcyclopropyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: (2S)-4-[(1R,2S)-2-methylcyclopropanecarbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: (2S)-4-[(1R,2S)-2-methylcyclopropanecarbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)N2CC(OC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C[C@H]1C[C@H]1C(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C14H15NO4/c1-8-6-9(8)13(16)15-7-12(14(17)18)19-11-5-3-2-4-10(11)15/h2-5,8-9,12H,6-7H2,1H3,(H,17,18)/t8-,9+,12-/m0/s1