N-cyano-N'-(6-cyano-3-oxidanyl-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-yl)pyridine-3-carboximidamide

Systemtic Name: N-cyano-N'-(6-cyano-3-oxidanyl-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-yl)pyridine-3-carboximidamide Openeye Name: N-cyano-N'-(6-cyano-3-hydroxy-spiro[chromane-2,1'-cyclohexane]-4-yl)pyridine-3-carboxamidine CAS Name: N-cyano-N'-(6-cyano-3-hydroxy-4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]yl)-3-pyridinecarboximidamide IUPAC Name: N-cyano-N'-(6-cyano-3-hydroxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-yl)pyridine-3-carboximidamide Traditional Name: N-cyano-N'-(6-cyano-3-hydroxy-spiro[chroman-2,1'-cyclohexane]-4-yl)nicotinamidine Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(C3=C(O2)C=CC(=C3)C#N)N=C(C4=CN=CC=C4)NC#N)O

Isomeric SMILES

C1CCC2(CC1)C(C(C3=C(O2)C=CC(=C3)C#N)N=C(C4=CN=CC=C4)NC#N)O

InChI

InChI=1S/C22H21N5O2/c23-12-15-6-7-18-17(11-15)19(20(28)22(29-18)8-2-1-3-9-22)27-21(26-14-24)16-5-4-10-25-13-16/h4-7,10-11,13,19-20,28H,1-3,8-9H2,(H,26,27)