[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]methylammonium CAS Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-thiazolyl]methylammonium IUPAC Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]methylammonium Formula: C13H15N2O2S+ MolecularWeight: 263.3354

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=CSC(=N3)C[NH3+])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=CSC(=N3)C[NH3+])OC1

InChI

InChI=1S/C13H14N2O2S/c14-7-13-15-10(8-18-13)9-2-3-11-12(6-9)17-5-1-4-16-11/h2-3,6,8H,1,4-5,7,14H2/p+1