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

Systemtic Name: 2-[2-[4-(methylamino)phenyl]ethyl]-4,5-dipentoxy-3H-isoindol-1-one Openeye Name: 2-[2-[4-(methylamino)phenyl]ethyl]-4,5-dipentoxy-isoindolin-1-one CAS Name: 2-[2-[4-(methylamino)phenyl]ethyl]-4,5-dipentoxy-3H-isoindol-1-one IUPAC Name: 2-[2-[4-(methylamino)phenyl]ethyl]-4,5-dipentoxy-3H-isoindol-1-one Traditional Name: 4,5-diamoxy-2-[2-[4-(methylamino)phenyl]ethyl]isoindolin-1-one Formula: C27H38N2O3 MolecularWeight: 438.60222

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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)NC)OCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C27H38N2O3/c1-4-6-8-18-31-25-15-14-23-24(26(25)32-19-9-7-5-2)20-29(27(23)30)17-16-21-10-12-22(28-3)13-11-21/h10-15,28H,4-9,16-20H2,1-3H3