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

Systemtic Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-phenyl-quinazolin-4-yl]amino]propan-1-ol Openeye Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6-phenyl-quinazolin-4-yl]amino]propan-1-ol CAS Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-phenyl-4-quinazolinyl]amino]-1-propanol IUPAC Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-6-phenylquinazolin-4-yl]amino]propan-1-ol Traditional Name: 3-[[2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-6-phenyl-quinazolin-4-yl]amino]propan-1-ol Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC2=NC3=C(C=C(C=C3)C4=CC=CC=C4)C(=N2)NCCCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C2=NC3=C(C=C(C=C3)C4=CC=CC=C4)C(=N2)NCCCO)OC

InChI

InChI=1S/C27H27N3O3/c1-32-22-15-19(16-23(18-22)33-2)9-12-26-29-25-11-10-21(20-7-4-3-5-8-20)17-24(25)27(30-26)28-13-6-14-31/h3-5,7-12,15-18,31H,6,13-14H2,1-2H3,(H,28,29,30)/b12-9+