6-azanyl-3-butyl-4'-phenyl-spiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]-5-carbonitrile

Systemtic Name: 6-azanyl-3-butyl-4'-phenyl-spiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]-5-carbonitrile Openeye Name: 6-amino-3-butyl-4'-phenyl-spiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]-5-carbonitrile CAS Name: 6-amino-3-butyl-4'-phenyl-5-spiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]carbonitrile IUPAC Name: 6-amino-3-butyl-4'-phenylspiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]-5-carbonitrile Traditional Name: 6-amino-3-butyl-4'-phenyl-spiro[2H-pyrano[2,3-c]pyrazole-4,1'-cyclohexane]-5-carbonitrile Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=NN1)OC(=C(C23CCC(CC3)C4=CC=CC=C4)C#N)N

Isomeric SMILES

CCCCC1=C2C(=NN1)OC(=C(C23CCC(CC3)C4=CC=CC=C4)C#N)N

InChI

InChI=1S/C22H26N4O/c1-2-3-9-18-19-21(26-25-18)27-20(24)17(14-23)22(19)12-10-16(11-13-22)15-7-5-4-6-8-15/h4-8,16H,2-3,9-13,24H2,1H3,(H,25,26)