4-[3-[3-[(2-methylpropan-2-yl)oxymethyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzenecarbonitrile

Systemtic Name: 4-[3-[3-[(2-methylpropan-2-yl)oxymethyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzenecarbonitrile Openeye Name: 4-[3-[3-(tert-butoxymethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzonitrile CAS Name: 4-[3-[3-[(2-methylpropan-2-yl)oxymethyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzonitrile IUPAC Name: 4-[3-[3-[(2-methylpropan-2-yl)oxymethyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzonitrile Traditional Name: 4-[3-[3-(tert-butoxymethyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonan-7-yl]propylamino]benzonitrile Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCN1CC2CN(CC(C1)O2)CCCNC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OCN1CC2CN(CC(C1)O2)CCCNC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H32N4O2/c1-21(2,3)26-16-25-14-19-12-24(13-20(15-25)27-19)10-4-9-23-18-7-5-17(11-22)6-8-18/h5-8,19-20,23H,4,9-10,12-16H2,1-3H3