3-[1-(3-oxidanylpropyl)indazol-3-yl]-4-(1-pyridin-2-ylindol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[1-(3-oxidanylpropyl)indazol-3-yl]-4-(1-pyridin-2-ylindol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[1-(3-hydroxypropyl)indazol-3-yl]-4-[1-(2-pyridyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-[1-(3-hydroxypropyl)-3-indazolyl]-4-[1-(2-pyridinyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-[1-(3-hydroxypropyl)indazol-3-yl]-4-(1-pyridin-2-ylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-(3-hydroxypropyl)indazol-3-yl]-4-[1-(2-pyridyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C27H21N5O3 MolecularWeight: 463.48734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C3=CC=CC=N3)C4=C(C(=O)NC4=O)C5=NN(C6=CC=CC=C65)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=CC=CC=N3)C4=C(C(=O)NC4=O)C5=NN(C6=CC=CC=C65)CCCO

InChI

InChI=1S/C27H21N5O3/c33-15-7-14-32-21-11-4-2-9-18(21)25(30-32)24-23(26(34)29-27(24)35)19-16-31(22-12-5-6-13-28-22)20-10-3-1-8-17(19)20/h1-6,8-13,16,33H,7,14-15H2,(H,29,34,35)