5-chloranyl-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole Openeye Name: 5-chloro-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole CAS Name: 5-chloro-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole IUPAC Name: 5-chloro-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole Traditional Name: 5-chloro-2-(1,4-diazepan-1-ylmethyl)-1,3-benzoxazole Formula: C13H16ClN3O MolecularWeight: 265.73864

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CC2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

C1CNCCN(C1)CC2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C13H16ClN3O/c14-10-2-3-12-11(8-10)16-13(18-12)9-17-6-1-4-15-5-7-17/h2-3,8,15H,1,4-7,9H2