3-(2-chlorophenyl)-4-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(2-chlorophenyl)-4-[1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(2-chlorophenyl)-4-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(2-chlorophenyl)-4-[1-(3-hydroxypropyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(2-chlorophenyl)-4-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(2-chlorophenyl)-4-[1-(3-hydroxypropyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C21H17ClN2O3 MolecularWeight: 380.82428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCCO)C3=C(C(=O)NC3=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCCO)C3=C(C(=O)NC3=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H17ClN2O3/c22-16-8-3-1-7-14(16)18-19(21(27)23-20(18)26)15-12-24(10-5-11-25)17-9-4-2-6-13(15)17/h1-4,6-9,12,25H,5,10-11H2,(H,23,26,27)