6-methoxy-2-(3-morpholin-4-ylpropyl)-5-pentoxy-4H-isoquinoline-1,3-dione hydrochloride

Systemtic Name: 6-methoxy-2-(3-morpholin-4-ylpropyl)-5-pentoxy-4H-isoquinoline-1,3-dione hydrochloride Openeye Name: 6-methoxy-2-(3-morpholinopropyl)-5-pentoxy-4H-isoquinoline-1,3-dione hydrochloride CAS Name: 6-methoxy-2-[3-(4-morpholinyl)propyl]-5-pentoxy-4H-isoquinoline-1,3-dione hydrochloride IUPAC Name: 6-methoxy-2-(3-morpholin-4-ylpropyl)-5-pentoxy-4H-isoquinoline-1,3-dione hydrochloride Traditional Name: 5-amoxy-6-methoxy-2-(3-morpholinopropyl)-4H-isoquinoline-1,3-quinone hydrochloride Formula: C22H33ClN2O5 MolecularWeight: 440.96082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC2=C1CC(=O)N(C2=O)CCCN3CCOCC3)OC.Cl

Isomeric SMILES

CCCCCOC1=C(C=CC2=C1CC(=O)N(C2=O)CCCN3CCOCC3)OC.Cl

InChI

InChI=1S/C22H32N2O5.ClH/c1-3-4-5-13-29-21-18-16-20(25)24(10-6-9-23-11-14-28-15-12-23)22(26)17(18)7-8-19(21)27-2;/h7-8H,3-6,9-16H2,1-2H3;1H