3-[(2S)-6-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[(2S)-6-azanyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethyl-azanium Openeye Name: 3-[(2S)-6-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium CAS Name: 3-[(2S)-6-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethylammonium IUPAC Name: 3-[(2S)-6-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethylazanium Traditional Name: 3-[(2S)-6-amino-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]propyl-dimethyl-ammonium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)N)CCC[NH+](C)C

Isomeric SMILES

C[C@H]1CN(C2=C(O1)C=CC(=C2)N)CCC[NH+](C)C

InChI

InChI=1S/C14H23N3O/c1-11-10-17(8-4-7-16(2)3)13-9-12(15)5-6-14(13)18-11/h5-6,9,11H,4,7-8,10,15H2,1-3H3/p+1/t11-/m0/s1