1-cyano-1-[2-(dimethoxymethyl)-2-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(4-methoxyphenyl)guanidine

Systemtic Name: 1-cyano-1-[2-(dimethoxymethyl)-2-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]-2-(4-methoxyphenyl)guanidine Openeye Name: 1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-chroman-4-yl]-2-(4-methoxyphenyl)guanidine CAS Name: 1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-2-(4-methoxyphenyl)guanidine IUPAC Name: 1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-3,4-dihydrochromen-4-yl]-2-(4-methoxyphenyl)guanidine Traditional Name: 1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-chroman-4-yl]-2-(4-methoxyphenyl)guanidine Formula: C22H25N5O7 MolecularWeight: 471.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(C#N)C(=NC3=CC=C(C=C3)OC)N)O)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N(C#N)C(=NC3=CC=C(C=C3)OC)N)O)C(OC)OC

InChI

InChI=1S/C22H25N5O7/c1-22(20(32-3)33-4)19(28)18(16-11-14(27(29)30)7-10-17(16)34-22)26(12-23)21(24)25-13-5-8-15(31-2)9-6-13/h5-11,18-20,28H,1-4H3,(H2,24,25)