2-azanyl-6-(2-ethoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(2-ethoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-6-(2-ethoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-6-(2-ethoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-ethoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-6-o-phenetyl-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(C2(C(C2(C(=N1)N)C#N)C3=CC=CC=C3OCC)C#N)OCCC

Isomeric SMILES

CCCOC1(C2(C(C2(C(=N1)N)C#N)C3=CC=CC=C3OCC)C#N)OCCC

InChI

InChI=1S/C21H26N4O3/c1-4-11-27-21(28-12-5-2)20(14-23)17(19(20,13-22)18(24)25-21)15-9-7-8-10-16(15)26-6-3/h7-10,17H,4-6,11-12H2,1-3H3,(H2,24,25)