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

Systemtic Name: cyclohexyl (2S)-2-[(2S)-6-ethanoyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Openeye Name: cyclohexyl (2S)-2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl (2S)-2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2S)-6-acetyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propionic acid cyclohexyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)C(=O)C)C(C)C(=O)OC3CCCCC3

Isomeric SMILES

CC[C@H]1CN(C2=C(O1)C=CC(=C2)C(=O)C)[C@@H](C)C(=O)OC3CCCCC3

InChI

InChI=1S/C21H29NO4/c1-4-17-13-22(14(2)21(24)26-18-8-6-5-7-9-18)19-12-16(15(3)23)10-11-20(19)25-17/h10-12,14,17-18H,4-9,13H2,1-3H3/t14-,17-/m0/s1