(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethyl-morpholin-4-ium

Systemtic Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethyl-morpholin-4-ium Openeye Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethyl-morpholin-4-ium CAS Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethylmorpholin-4-ium IUPAC Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethylmorpholin-4-ium Traditional Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5,5-trimethyl-morpholin-4-ium Formula: C15H22NO3+ MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCC([NH2+]1)(C)C2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

C[C@@]1(COCC([NH2+]1)(C)C)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H21NO3/c1-14(2)9-17-10-15(3,16-14)11-4-5-12-13(8-11)19-7-6-18-12/h4-5,8,16H,6-7,9-10H2,1-3H3/p+1/t15-/m1/s1