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

Systemtic Name: 2-azanyl-6-(4-octoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-6-(4-octoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-6-(4-octoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-6-(4-octoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-6-(4-octoxyphenyl)-4,4-dipropoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2C3(C2(C(N=C3N)(OCCC)OCCC)C#N)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2C3(C2(C(N=C3N)(OCCC)OCCC)C#N)C#N

InChI

InChI=1S/C27H38N4O3/c1-4-7-8-9-10-11-18-32-22-14-12-21(13-15-22)23-25(19-28)24(30)31-27(33-16-5-2,34-17-6-3)26(23,25)20-29/h12-15,23H,4-11,16-18H2,1-3H3,(H2,30,31)