[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]ammonium Formula: C20H23N2O3S+ MolecularWeight: 371.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1COC2=CC=CC=C2O1)CC3=C(OC(=N3)C4=CC=CS4)C

Isomeric SMILES

CC[NH+](C[C@H]1COC2=CC=CC=C2O1)CC3=C(OC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C20H22N2O3S/c1-3-22(11-15-13-23-17-7-4-5-8-18(17)25-15)12-16-14(2)24-20(21-16)19-9-6-10-26-19/h4-10,15H,3,11-13H2,1-2H3/p+1/t15-/m0/s1