2-hexyl-4-(4-phenylbutoxy)isoindole-1,3-dione

Systemtic Name: 2-hexyl-4-(4-phenylbutoxy)isoindole-1,3-dione Openeye Name: 2-hexyl-4-(4-phenylbutoxy)isoindoline-1,3-dione CAS Name: 2-hexyl-4-(4-phenylbutoxy)isoindole-1,3-dione IUPAC Name: 2-hexyl-4-(4-phenylbutoxy)isoindole-1,3-dione Traditional Name: 2-hexyl-4-(4-phenylbutoxy)isoindoline-1,3-quinone Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=C(C1=O)C(=CC=C2)OCCCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCN1C(=O)C2=C(C1=O)C(=CC=C2)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C24H29NO3/c1-2-3-4-9-17-25-23(26)20-15-11-16-21(22(20)24(25)27)28-18-10-8-14-19-12-6-5-7-13-19/h5-7,11-13,15-16H,2-4,8-10,14,17-18H2,1H3