(2R)-4-[(2S)-2-methylpentanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: (2R)-4-[(2S)-2-methylpentanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: (2R)-4-[(2S)-2-methylpentanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2R)-4-[(2S)-2-methyl-1-oxopentyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate IUPAC Name: (2R)-4-[(2S)-2-methylpentanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2R)-4-[(2S)-2-methylpentanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate Formula: C15H18NO4- MolecularWeight: 276.30772

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)N1CC(OC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CCC[C@H](C)C(=O)N1C[C@@H](OC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C15H19NO4/c1-3-6-10(2)14(17)16-9-13(15(18)19)20-12-8-5-4-7-11(12)16/h4-5,7-8,10,13H,3,6,9H2,1-2H3,(H,18,19)/p-1/t10-,13+/m0/s1