2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-6-nitro-3-oxidanyl-3,4-dihydro-2H-chromen-4-yl]guanidine

Systemtic Name: 2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-6-nitro-3-oxidanyl-3,4-dihydro-2H-chromen-4-yl]guanidine Openeye Name: 2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-nitro-chroman-4-yl]guanidine CAS Name: 2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]guanidine IUPAC Name: 2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-nitro-3,4-dihydro-2H-chromen-4-yl]guanidine Traditional Name: 2-(2-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-6-nitro-chroman-4-yl]guanidine Formula: C20H20ClN5O6 MolecularWeight: 461.8557

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(C#N)C(=NC3=CC=CC=C3Cl)N)O)OC

Isomeric SMILES

COC(C1C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(C#N)C(=NC3=CC=CC=C3Cl)N)O)OC

InChI

InChI=1S/C20H20ClN5O6/c1-30-19(31-2)18-17(27)16(12-9-11(26(28)29)7-8-15(12)32-18)25(10-22)20(23)24-14-6-4-3-5-13(14)21/h3-9,16-19,27H,1-2H3,(H2,23,24)