4-(3,3-dimethyl-4-phenyl-but-1-ynyl)-6,7-dimethoxy-quinazoline

Systemtic Name: 4-(3,3-dimethyl-4-phenyl-but-1-ynyl)-6,7-dimethoxy-quinazoline Openeye Name: 4-(3,3-dimethyl-4-phenyl-but-1-ynyl)-6,7-dimethoxy-quinazoline CAS Name: 4-(3,3-dimethyl-4-phenylbut-1-ynyl)-6,7-dimethoxyquinazoline IUPAC Name: 4-(3,3-dimethyl-4-phenylbut-1-ynyl)-6,7-dimethoxyquinazoline Traditional Name: 4-(3,3-dimethyl-4-phenyl-but-1-ynyl)-6,7-dimethoxy-quinazoline Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)C#CC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)C#CC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C22H22N2O2/c1-22(2,14-16-8-6-5-7-9-16)11-10-18-17-12-20(25-3)21(26-4)13-19(17)24-15-23-18/h5-9,12-13,15H,14H2,1-4H3