(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C17H15BrClNO5 MolecularWeight: 428.6617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)Cl)N

InChI

InChI=1S/C17H15BrClNO5/c1-22-14-7-13(20)12(19)5-10(14)17(21)25-8-9-4-15-16(6-11(9)18)24-3-2-23-15/h4-7H,2-3,8,20H2,1H3