2-[[6-chloranyl-2-methyl-4-(naphthalen-1-ylmethoxy)-1-oxidanylidene-isoquinolin-3-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[6-chloranyl-2-methyl-4-(naphthalen-1-ylmethoxy)-1-oxidanylidene-isoquinolin-3-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[6-chloro-2-methyl-4-(1-naphthylmethoxy)-1-oxo-3-isoquinolyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[6-chloro-2-methyl-4-(1-naphthalenylmethoxy)-1-oxo-3-isoquinolinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[6-chloro-2-methyl-4-(naphthalen-1-ylmethoxy)-1-oxoisoquinolin-3-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[6-chloro-1-keto-2-methyl-4-(1-naphthylmethoxy)-3-isoquinolyl]methyl]isoindoline-1,3-quinone Formula: C30H21ClN2O4 MolecularWeight: 508.95174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=CC=CC4=CC=CC=C43)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=CC=CC4=CC=CC=C43)CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C30H21ClN2O4/c1-32-26(16-33-29(35)22-11-4-5-12-23(22)30(33)36)27(25-15-20(31)13-14-24(25)28(32)34)37-17-19-9-6-8-18-7-2-3-10-21(18)19/h2-15H,16-17H2,1H3