4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenyl-isoquinoline

Systemtic Name: 4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenyl-isoquinoline Openeye Name: 4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenyl-isoquinoline CAS Name: 4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenylisoquinoline IUPAC Name: 4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenylisoquinoline Traditional Name: 4-(7-ethoxy-2-ethyl-2,5-diazabicyclo[4.1.0]heptan-5-yl)-1-phenyl-isoquinoline Formula: C24H27N3O MolecularWeight: 373.49068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C2C1C2OCC)C3=CN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCN1CCN(C2C1C2OCC)C3=CN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H27N3O/c1-3-26-14-15-27(23-22(26)24(23)28-4-2)20-16-25-21(17-10-6-5-7-11-17)19-13-9-8-12-18(19)20/h5-13,16,22-24H,3-4,14-15H2,1-2H3