2-[4-[[4-(1H-indol-5-yloxy)-6-methoxy-quinazolin-7-yl]oxymethyl]piperidin-1-yl]ethanenitrile

Systemtic Name: 2-[4-[[4-(1H-indol-5-yloxy)-6-methoxy-quinazolin-7-yl]oxymethyl]piperidin-1-yl]ethanenitrile Openeye Name: 2-[4-[[4-(1H-indol-5-yloxy)-6-methoxy-quinazolin-7-yl]oxymethyl]-1-piperidyl]acetonitrile CAS Name: 2-[4-[[4-(1H-indol-5-yloxy)-6-methoxy-7-quinazolinyl]oxymethyl]-1-piperidinyl]acetonitrile IUPAC Name: 2-[4-[[4-(1H-indol-5-yloxy)-6-methoxyquinazolin-7-yl]oxymethyl]piperidin-1-yl]acetonitrile Traditional Name: 2-[4-[[4-(1H-indol-5-yloxy)-6-methoxy-quinazolin-7-yl]oxymethyl]piperidino]acetonitrile Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC4=C(C=C3)NC=C4)OCC5CCN(CC5)CC#N

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)OC3=CC4=C(C=C3)NC=C4)OCC5CCN(CC5)CC#N

InChI

InChI=1S/C25H25N5O3/c1-31-23-13-20-22(14-24(23)32-15-17-5-9-30(10-6-17)11-7-26)28-16-29-25(20)33-19-2-3-21-18(12-19)4-8-27-21/h2-4,8,12-14,16-17,27H,5-6,9-11,15H2,1H3