2-[(3R)-1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[(3R)-1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-yl]oxybenzenecarbonitrile Openeye Name: 2-[(3R)-1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-yl]oxybenzonitrile CAS Name: 2-[[(3R)-1-(6,7-dimethoxy-4-quinazolinyl)-3-pyrrolidinyl]oxy]benzonitrile IUPAC Name: 2-[(3R)-1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-yl]oxybenzonitrile Traditional Name: 2-[(3R)-1-(6,7-dimethoxyquinazolin-4-yl)pyrrolidin-3-yl]oxybenzonitrile Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC(C3)OC4=CC=CC=C4C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CC[C@H](C3)OC4=CC=CC=C4C#N)OC

InChI

InChI=1S/C21H20N4O3/c1-26-19-9-16-17(10-20(19)27-2)23-13-24-21(16)25-8-7-15(12-25)28-18-6-4-3-5-14(18)11-22/h3-6,9-10,13,15H,7-8,12H2,1-2H3/t15-/m1/s1