1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone

Systemtic Name: 1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone Openeye Name: 1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone CAS Name: 1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone IUPAC Name: 1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone Traditional Name: 1-[(2S)-2-ethyl-4-(3-phenoxypropyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethanone Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(C2=C(O1)C=CC(=C2)C(=O)C)CCCOC3=CC=CC=C3

Isomeric SMILES

CC[C@H]1CN(C2=C(O1)C=CC(=C2)C(=O)C)CCCOC3=CC=CC=C3

InChI

InChI=1S/C21H25NO3/c1-3-18-15-22(12-7-13-24-19-8-5-4-6-9-19)20-14-17(16(2)23)10-11-21(20)25-18/h4-6,8-11,14,18H,3,7,12-13,15H2,1-2H3/t18-/m0/s1