3-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)pyrrole-2,5-dione CAS Name: 3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-phenoxyphenyl)-3-pyrroline-2,5-quinone Formula: C25H19ClN2O3 MolecularWeight: 430.88296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C(=O)N(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C(=O)N(C3=O)C4=CC=C(C=C4)OC5=CC=CC=C5)Cl

InChI

InChI=1S/C25H19ClN2O3/c26-22-23(27-15-14-17-6-4-5-7-18(17)16-27)25(30)28(24(22)29)19-10-12-21(13-11-19)31-20-8-2-1-3-9-20/h1-13H,14-16H2