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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)C4=C(C(=O)NC4=O)C5=NN(C6=CC=CC=C65)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C3=CN=CC=C3)C4=C(C(=O)NC4=O)C5=NN(C6=CC=CC=C65)CCCO

InChI

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