1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-hydroxyphenyl)propyl]ammonium Formula: C17H19N2OS+ MolecularWeight: 299.41056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)O)[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)O)[NH2+]CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N2OS/c1-2-14(12-7-9-13(20)10-8-12)18-11-17-19-15-5-3-4-6-16(15)21-17/h3-10,14,18,20H,2,11H2,1H3/p+1/t14-/m0/s1