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

Systemtic Name: cyclohexyl (2S)-2-[(2S)-6-azanyl-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Openeye Name: cyclohexyl (2S)-2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl (2S)-2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2S)-6-amino-2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl]propionic acid cyclohexyl ester Formula: C19H28N2O3 MolecularWeight: 332.43722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O3/c1-3-15-12-21(17-11-14(20)9-10-18(17)23-15)13(2)19(22)24-16-7-5-4-6-8-16/h9-11,13,15-16H,3-8,12,20H2,1-2H3/t13-,15-/m0/s1