N-butyl-N-methyl-5-[(5-morpholin-4-yl-1,3-dihydroisoindol-2-yl)carbonyl]-2,4-bis(oxidanyl)benzamide

Systemtic Name: N-butyl-N-methyl-5-[(5-morpholin-4-yl-1,3-dihydroisoindol-2-yl)carbonyl]-2,4-bis(oxidanyl)benzamide Openeye Name: N-butyl-2,4-dihydroxy-N-methyl-5-(5-morpholinoisoindoline-2-carbonyl)benzamide CAS Name: N-butyl-2,4-dihydroxy-N-methyl-5-[[5-(4-morpholinyl)-1,3-dihydroisoindol-2-yl]-oxomethyl]benzamide IUPAC Name: N-butyl-2,4-dihydroxy-N-methyl-5-(5-morpholin-4-yl-1,3-dihydroisoindole-2-carbonyl)benzamide Traditional Name: N-butyl-2,4-dihydroxy-N-methyl-5-(5-morpholinoisoindoline-2-carbonyl)benzamide Formula: C25H31N3O5 MolecularWeight: 453.53074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(C=C(C(=C1)C(=O)N2CC3=C(C2)C=C(C=C3)N4CCOCC4)O)O

Isomeric SMILES

CCCCN(C)C(=O)C1=C(C=C(C(=C1)C(=O)N2CC3=C(C2)C=C(C=C3)N4CCOCC4)O)O

InChI

InChI=1S/C25H31N3O5/c1-3-4-7-26(2)24(31)20-13-21(23(30)14-22(20)29)25(32)28-15-17-5-6-19(12-18(17)16-28)27-8-10-33-11-9-27/h5-6,12-14,29-30H,3-4,7-11,15-16H2,1-2H3