2-[3-[4-chloranyl-2-(phenylmethyl)phenyl]prop-2-ynyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-chloranyl-2-(phenylmethyl)phenyl]prop-2-ynyl]isoindole-1,3-dione Openeye Name: 2-[3-(2-benzyl-4-chloro-phenyl)prop-2-ynyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-chloro-2-(phenylmethyl)phenyl]prop-2-ynyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2-benzyl-4-chlorophenyl)prop-2-ynyl]isoindole-1,3-dione Traditional Name: 2-[3-(2-benzyl-4-chloro-phenyl)prop-2-ynyl]isoindoline-1,3-quinone Formula: C24H16ClNO2 MolecularWeight: 385.84234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)C#CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)C#CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H16ClNO2/c25-20-13-12-18(19(16-20)15-17-7-2-1-3-8-17)9-6-14-26-23(27)21-10-4-5-11-22(21)24(26)28/h1-5,7-8,10-13,16H,14-15H2