methyl 4-[[(2S)-6-ethanoyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2S)-6-ethanoyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: methyl 4-[[(2S)-6-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 4-[[(2S)-6-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-6-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 4-[[(2S)-6-acetyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]methyl]benzoic acid methyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)C(=O)C)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

C[C@H]1CN(C2=C(O1)C=CC(=C2)C(=O)C)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21NO4/c1-13-11-21(12-15-4-6-16(7-5-15)20(23)24-3)18-10-17(14(2)22)8-9-19(18)25-13/h4-10,13H,11-12H2,1-3H3/t13-/m0/s1