4-(3-bromanylpropyl)-7-methoxy-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-(3-bromanylpropyl)-7-methoxy-1,4-benzoxazepine-3,5-dione Openeye Name: 4-(3-bromopropyl)-7-methoxy-1,4-benzoxazepine-3,5-dione CAS Name: 4-(3-bromopropyl)-7-methoxy-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-(3-bromopropyl)-7-methoxy-1,4-benzoxazepine-3,5-dione Traditional Name: 4-(3-bromopropyl)-7-methoxy-1,4-benzoxazepine-3,5-quinone Formula: C13H14BrNO4 MolecularWeight: 328.15856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=O)N(C2=O)CCCBr

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(=O)N(C2=O)CCCBr

InChI

InChI=1S/C13H14BrNO4/c1-18-9-3-4-11-10(7-9)13(17)15(6-2-5-14)12(16)8-19-11/h3-4,7H,2,5-6,8H2,1H3