4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: 4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: 4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate IUPAC Name: 4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 4-[[(2S)-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Formula: C17H16NO3- MolecularWeight: 282.31384

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C[C@H]1CN(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H17NO3/c1-12-10-18(15-4-2-3-5-16(15)21-12)11-13-6-8-14(9-7-13)17(19)20/h2-9,12H,10-11H2,1H3,(H,19,20)/p-1/t12-/m0/s1