[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]methanamine

Systemtic Name: [3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]methanamine Openeye Name: [3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]methanamine CAS Name: [3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]methanamine IUPAC Name: [3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]methanamine Traditional Name: [3-(4-chlorophenyl)anthranil-5-yl]methylamine Formula: C14H11ClN2O MolecularWeight: 258.70294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)CN)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)CN)Cl

InChI

InChI=1S/C14H11ClN2O/c15-11-4-2-10(3-5-11)14-12-7-9(8-16)1-6-13(12)17-18-14/h1-7H,8,16H2