5-chloranyl-3-(piperidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-(piperidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-(piperidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-(1-piperidin-1-iumylmethyl)-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-(piperidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-(piperidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Formula: C13H16ClN2O2+ MolecularWeight: 267.73134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C3=C(C=CC(=C3)Cl)OC2=O

Isomeric SMILES

C1CC[NH+](CC1)CN2C3=C(C=CC(=C3)Cl)OC2=O

InChI

InChI=1S/C13H15ClN2O2/c14-10-4-5-12-11(8-10)16(13(17)18-12)9-15-6-2-1-3-7-15/h4-5,8H,1-3,6-7,9H2/p+1