3-(1H-indol-3-yl)-4-phenylazanyl-1-(3-piperidin-1-ylpropyl)pyrrole-2,5-dione

Systemtic Name: 3-(1H-indol-3-yl)-4-phenylazanyl-1-(3-piperidin-1-ylpropyl)pyrrole-2,5-dione Openeye Name: 3-anilino-4-(1H-indol-3-yl)-1-[3-(1-piperidyl)propyl]pyrrole-2,5-dione CAS Name: 3-anilino-4-(1H-indol-3-yl)-1-[3-(1-piperidinyl)propyl]pyrrole-2,5-dione IUPAC Name: 3-anilino-4-(1H-indol-3-yl)-1-(3-piperidin-1-ylpropyl)pyrrole-2,5-dione Traditional Name: 3-anilino-4-(1H-indol-3-yl)-1-(3-piperidinopropyl)-3-pyrroline-2,5-quinone Formula: C26H28N4O2 MolecularWeight: 428.52612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C(=O)C(=C(C2=O)NC3=CC=CC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCN(CC1)CCCN2C(=O)C(=C(C2=O)NC3=CC=CC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H28N4O2/c31-25-23(21-18-27-22-13-6-5-12-20(21)22)24(28-19-10-3-1-4-11-19)26(32)30(25)17-9-16-29-14-7-2-8-15-29/h1,3-6,10-13,18,27-28H,2,7-9,14-17H2