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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)C(=O)C)CCCCOC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN(C2=C(O1)C=CC(=C2)C(=O)C)CCCCOC3=CC=CC=C3

InChI

InChI=1S/C21H25NO3/c1-16-15-22(12-6-7-13-24-19-8-4-3-5-9-19)20-14-18(17(2)23)10-11-21(20)25-16/h3-5,8-11,14,16H,6-7,12-13,15H2,1-2H3/t16-/m0/s1