7-azanyl-3-(3-bromanylpropoxy)-4-chloranyl-isochromen-1-one

Systemtic Name: 7-azanyl-3-(3-bromanylpropoxy)-4-chloranyl-isochromen-1-one Openeye Name: 7-amino-3-(3-bromopropoxy)-4-chloro-isochromen-1-one CAS Name: 7-amino-3-(3-bromopropoxy)-4-chloro-2-benzopyran-1-one IUPAC Name: 7-amino-3-(3-bromopropoxy)-4-chloroisochromen-1-one Traditional Name: 7-amino-3-(3-bromopropoxy)-4-chloro-isocoumarin Formula: C12H11BrClNO3 MolecularWeight: 332.57764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N)C(=O)OC(=C2Cl)OCCCBr

Isomeric SMILES

C1=CC2=C(C=C1N)C(=O)OC(=C2Cl)OCCCBr

InChI

InChI=1S/C12H11BrClNO3/c13-4-1-5-17-12-10(14)8-3-2-7(15)6-9(8)11(16)18-12/h2-3,6H,1,4-5,15H2