3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-methoxy-quinazolin-4-yl]amino]propan-1-ol

Systemtic Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-methoxy-quinazolin-4-yl]amino]propan-1-ol Openeye Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6-methoxy-quinazolin-4-yl]amino]propan-1-ol CAS Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-methoxy-4-quinazolinyl]amino]-1-propanol IUPAC Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-methoxyquinazolin-4-yl]amino]propan-1-ol Traditional Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6-methoxy-quinazolin-4-yl]amino]propan-1-ol Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C2NCCCO)C=CC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C2NCCCO)/C=C/C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C22H25N3O4/c1-27-16-6-7-20-19(14-16)22(23-9-4-10-26)25-21(24-20)8-5-15-11-17(28-2)13-18(12-15)29-3/h5-8,11-14,26H,4,9-10H2,1-3H3,(H,23,24,25)/b8-5+