1,3-benzothiazol-2-ylmethyl-[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C14H18N3O3S+ MolecularWeight: 308.37602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)OC)[NH+](C)CC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)[NH+](C)CC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H17N3O3S/c1-9(13(18)16-14(19)20-3)17(2)8-12-15-10-6-4-5-7-11(10)21-12/h4-7,9H,8H2,1-3H3,(H,16,18,19)/p+1/t9-/m1/s1