4-[(2-chloranyl-5-isothiocyanato-phenyl)methyl]morpholine

Systemtic Name: 4-[(2-chloranyl-5-isothiocyanato-phenyl)methyl]morpholine Openeye Name: 4-[(2-chloro-5-isothiocyanato-phenyl)methyl]morpholine CAS Name: 4-[(2-chloro-5-isothiocyanatophenyl)methyl]morpholine IUPAC Name: 4-[(2-chloro-5-isothiocyanatophenyl)methyl]morpholine Traditional Name: 4-(2-chloro-5-isothiocyanato-benzyl)morpholine Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C=CC(=C2)N=C=S)Cl

Isomeric SMILES

C1COCCN1CC2=C(C=CC(=C2)N=C=S)Cl

InChI

InChI=1S/C12H13ClN2OS/c13-12-2-1-11(14-9-17)7-10(12)8-15-3-5-16-6-4-15/h1-2,7H,3-6,8H2