(2Z)-2-[(2Z)-2-indol-3-ylideneethylidene]-6-iodanyl-3-(3-oxidanylpropyl)-1H-quinazolin-4-one

Systemtic Name: (2Z)-2-[(2Z)-2-indol-3-ylideneethylidene]-6-iodanyl-3-(3-oxidanylpropyl)-1H-quinazolin-4-one Openeye Name: (2Z)-3-(3-hydroxypropyl)-2-[(2Z)-2-indol-3-ylideneethylidene]-6-iodo-1H-quinazolin-4-one CAS Name: (2Z)-3-(3-hydroxypropyl)-2-[(2Z)-2-(3-indolylidene)ethylidene]-6-iodo-1H-quinazolin-4-one IUPAC Name: (2Z)-3-(3-hydroxypropyl)-2-[(2Z)-2-indol-3-ylideneethylidene]-6-iodo-1H-quinazolin-4-one Traditional Name: (2Z)-3-(3-hydroxypropyl)-2-[(2Z)-2-indol-3-ylideneethylidene]-6-iodo-1H-quinazolin-4-one Formula: C21H18IN3O2 MolecularWeight: 471.29099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C3NC4=C(C=C(C=C4)I)C(=O)N3CCCO)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C/C=C\3/NC4=C(C=C(C=C4)I)C(=O)N3CCCO)/C=N2

InChI

InChI=1S/C21H18IN3O2/c22-15-7-8-19-17(12-15)21(27)25(10-3-11-26)20(24-19)9-6-14-13-23-18-5-2-1-4-16(14)18/h1-2,4-9,12-13,24,26H,3,10-11H2/b14-6+,20-9-