(3E)-3-[7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-ylidene]-6-propyl-1H-indol-2-one hydrochloride

Systemtic Name: (3E)-3-[7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-ylidene]-6-propyl-1H-indol-2-one hydrochloride Openeye Name: (3E)-3-[7-(3-morpholinopropoxy)-1H-quinazolin-4-ylidene]-6-propyl-indolin-2-one hydrochloride CAS Name: (3E)-3-[7-[3-(4-morpholinyl)propoxy]-1H-quinazolin-4-ylidene]-6-propyl-1H-indol-2-one hydrochloride IUPAC Name: (3E)-3-[7-(3-morpholin-4-ylpropoxy)-1H-quinazolin-4-ylidene]-6-propyl-1H-indol-2-one hydrochloride Traditional Name: (3E)-3-[7-(3-morpholinopropoxy)-1H-quinazolin-4-ylidene]-6-propyl-oxindole hydrochloride Formula: C26H31ClN4O3 MolecularWeight: 483.00234

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)C(=C3C4=C(C=C(C=C4)OCCCN5CCOCC5)NC=N3)C(=O)N2.Cl

Isomeric SMILES

CCCC1=CC2=C(C=C1)/C(=C\3/C4=C(C=C(C=C4)OCCCN5CCOCC5)NC=N3)/C(=O)N2.Cl

InChI

InChI=1S/C26H30N4O3.ClH/c1-2-4-18-5-7-20-23(15-18)29-26(31)24(20)25-21-8-6-19(16-22(21)27-17-28-25)33-12-3-9-30-10-13-32-14-11-30;/h5-8,15-17H,2-4,9-14H2,1H3,(H,27,28)(H,29,31);1H/b25-24+;