propyl (2S)-2-[(2R)-6-ethanoyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: propyl (2S)-2-[(2R)-6-ethanoyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Openeye Name: propyl (2S)-2-[(2R)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2R)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoic acid propyl ester IUPAC Name: propyl (2S)-2-[(2R)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2R)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propionic acid propyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)N1CC(OC2=C1C=C(C=C2)C(=O)C)CC

Isomeric SMILES

CCCOC(=O)[C@H](C)N1C[C@H](OC2=C1C=C(C=C2)C(=O)C)CC

InChI

InChI=1S/C18H25NO4/c1-5-9-22-18(21)12(3)19-11-15(6-2)23-17-8-7-14(13(4)20)10-16(17)19/h7-8,10,12,15H,5-6,9,11H2,1-4H3/t12-,15+/m0/s1