2-[2-(4-dimethylaminophenyl)ethyl]-4,5-dipentoxy-3H-isoindol-1-one

Systemtic Name: 2-[2-(4-dimethylaminophenyl)ethyl]-4,5-dipentoxy-3H-isoindol-1-one Openeye Name: 2-[2-(4-dimethylaminophenyl)ethyl]-4,5-dipentoxy-isoindolin-1-one CAS Name: 2-[2-(4-dimethylaminophenyl)ethyl]-4,5-dipentoxy-3H-isoindol-1-one IUPAC Name: 2-[2-(4-dimethylaminophenyl)ethyl]-4,5-dipentoxy-3H-isoindol-1-one Traditional Name: 4,5-diamoxy-2-[2-(4-dimethylaminophenyl)ethyl]isoindolin-1-one Formula: C28H40N2O3 MolecularWeight: 452.6288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2)CCC3=CC=C(C=C3)N(C)C)OCCCCC

Isomeric SMILES

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2)CCC3=CC=C(C=C3)N(C)C)OCCCCC

InChI

InChI=1S/C28H40N2O3/c1-5-7-9-19-32-26-16-15-24-25(27(26)33-20-10-8-6-2)21-30(28(24)31)18-17-22-11-13-23(14-12-22)29(3)4/h11-16H,5-10,17-21H2,1-4H3