7-bromanyl-2-(phenylmethyl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 7-bromanyl-2-(phenylmethyl)-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 2-benzyl-7-bromo-1-(2-thienyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 7-bromo-2-(phenylmethyl)-1-thiophen-2-yl-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 2-benzyl-7-bromo-1-thiophen-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 2-benzyl-7-bromo-1-(2-thienyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C22H14BrNO3S MolecularWeight: 452.32046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Br)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Br)C5=CC=CS5

InChI

InChI=1S/C22H14BrNO3S/c23-14-8-9-16-15(11-14)20(25)18-19(17-7-4-10-28-17)24(22(26)21(18)27-16)12-13-5-2-1-3-6-13/h1-11,19H,12H2