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

Systemtic Name: 2-azanyl-4,4-dibutoxy-6-(4-hexoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-4,4-dibutoxy-6-(4-hexoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-4,4-dibutoxy-6-(4-hexoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-4,4-dibutoxy-6-(4-hexoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-4,4-dibutoxy-6-(4-hexoxyphenyl)-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:

CCCCCCOC1=CC=C(C=C1)C2C3(C2(C(N=C3N)(OCCCC)OCCCC)C#N)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2C3(C2(C(N=C3N)(OCCCC)OCCCC)C#N)C#N

InChI

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