(1aR,7aR)-1a-bromanyl-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-dione

Systemtic Name: (1aR,7aR)-1a-bromanyl-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-dione Openeye Name: (1aR,7aR)-1a-bromo-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-dione CAS Name: (1aR,7aR)-1a-bromo-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-dione IUPAC Name: (1aR,7aR)-1a-bromo-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-dione Traditional Name: (1aR,7aR)-1a-bromo-1,1-bis(4-methoxyphenyl)-7aH-cyclopropa[b]naphthalene-2,7-quinone Formula: C25H19BrO4 MolecularWeight: 463.31996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C3C2(C(=O)C4=CC=CC=C4C3=O)Br)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2([C@H]3[C@@]2(C(=O)C4=CC=CC=C4C3=O)Br)C5=CC=C(C=C5)OC

InChI

InChI=1S/C25H19BrO4/c1-29-17-11-7-15(8-12-17)24(16-9-13-18(30-2)14-10-16)22-21(27)19-5-3-4-6-20(19)23(28)25(22,24)26/h3-14,22H,1-2H3/t22-,25-/m0/s1