5-bromanyl-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]-3,4-dihydro-2H-chromene

Systemtic Name: 5-bromanyl-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]-3,4-dihydro-2H-chromene Openeye Name: 5-bromo-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]chromane CAS Name: 5-bromo-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]-3,4-dihydro-2H-1-benzopyran IUPAC Name: 5-bromo-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]-3,4-dihydro-2H-chromene Traditional Name: 5-bromo-6-methoxy-8-[(Z)-2-nitroprop-1-enyl]chroman Formula: C13H14BrNO4 MolecularWeight: 328.15856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=C(C2=C1OCCC2)Br)OC)[N+](=O)[O-]

Isomeric SMILES

C/C(=C/C1=CC(=C(C2=C1OCCC2)Br)OC)/[N+](=O)[O-]

InChI

InChI=1S/C13H14BrNO4/c1-8(15(16)17)6-9-7-11(18-2)12(14)10-4-3-5-19-13(9)10/h6-7H,3-5H2,1-2H3/b8-6-