8-chloranyl-3-(4-phenoxyphenyl)-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 8-chloranyl-3-(4-phenoxyphenyl)-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-8-chloro-3-(4-phenoxyphenyl)isoquinolin-1-one CAS Name: 8-chloro-3-(4-phenoxyphenyl)-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-8-chloro-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 2-benzyl-8-chloro-3-(4-phenoxyphenyl)isocarbostyril Formula: C28H20ClNO2 MolecularWeight: 437.9169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC3=C(C2=O)C(=CC=C3)Cl)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC3=C(C2=O)C(=CC=C3)Cl)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H20ClNO2/c29-25-13-7-10-22-18-26(30(28(31)27(22)25)19-20-8-3-1-4-9-20)21-14-16-24(17-15-21)32-23-11-5-2-6-12-23/h1-18H,19H2