hexyl 2-[(2S)-6-ethanoyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: hexyl 2-[(2S)-6-ethanoyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanoate Openeye Name: hexyl 2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]acetic acid hexyl ester IUPAC Name: hexyl 2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]acetic acid hexyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CN1CC(OC2=C1C=C(C=C2)C(=O)C)CC

Isomeric SMILES

CCCCCCOC(=O)CN1C[C@@H](OC2=C1C=C(C=C2)C(=O)C)CC

InChI

InChI=1S/C20H29NO4/c1-4-6-7-8-11-24-20(23)14-21-13-17(5-2)25-19-10-9-16(15(3)22)12-18(19)21/h9-10,12,17H,4-8,11,13-14H2,1-3H3/t17-/m0/s1