6-[(1S)-1-azanylpropyl]-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanylpropyl]-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-aminopropyl]-4-[(3,5-dimethylisoxazol-4-yl)methyl]-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-aminopropyl]-4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-aminopropyl]-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-aminopropyl]-4-[(3,5-dimethylisoxazol-4-yl)methyl]-1,4-benzoxazin-3-one Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC3=C(ON=C3C)C)N

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC3=C(ON=C3C)C)N

InChI

InChI=1S/C17H21N3O3/c1-4-14(18)12-5-6-16-15(7-12)20(17(21)9-22-16)8-13-10(2)19-23-11(13)3/h5-7,14H,4,8-9,18H2,1-3H3/t14-/m0/s1