2-[2,3-bis(chloranyl)phenyl]-1-cyano-1-(4-cyano-2-oxidanyl-3-propyl-phenyl)guanidine

Systemtic Name: 2-[2,3-bis(chloranyl)phenyl]-1-cyano-1-(4-cyano-2-oxidanyl-3-propyl-phenyl)guanidine Openeye Name: 1-cyano-1-(4-cyano-2-hydroxy-3-propyl-phenyl)-2-(2,3-dichlorophenyl)guanidine CAS Name: 1-cyano-1-(4-cyano-2-hydroxy-3-propylphenyl)-2-(2,3-dichlorophenyl)guanidine IUPAC Name: 1-cyano-1-(4-cyano-2-hydroxy-3-propylphenyl)-2-(2,3-dichlorophenyl)guanidine Traditional Name: 1-cyano-1-(4-cyano-2-hydroxy-3-propyl-phenyl)-2-(2,3-dichlorophenyl)guanidine Formula: C18H15Cl2N5O MolecularWeight: 388.2506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)N(C#N)C(=NC2=C(C(=CC=C2)Cl)Cl)N)C#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)N(C#N)C(=NC2=C(C(=CC=C2)Cl)Cl)N)C#N

InChI

InChI=1S/C18H15Cl2N5O/c1-2-4-12-11(9-21)7-8-15(17(12)26)25(10-22)18(23)24-14-6-3-5-13(19)16(14)20/h3,5-8,26H,2,4H2,1H3,(H2,23,24)