6-chloranyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-(1-pyrrolidin-1-iumylmethyl)-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-one Formula: C12H14ClN2O2+ MolecularWeight: 253.70476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CN2C3=C(C=C(C=C3)Cl)OC2=O

Isomeric SMILES

C1CC[NH+](C1)CN2C3=C(C=C(C=C3)Cl)OC2=O

InChI

InChI=1S/C12H13ClN2O2/c13-9-3-4-10-11(7-9)17-12(16)15(10)8-14-5-1-2-6-14/h3-4,7H,1-2,5-6,8H2/p+1