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

Systemtic Name: 1-[6-bromanyl-2-(dimethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1-cyano-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-[6-bromo-2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-1-cyano-guanidine CAS Name: 1-[6-bromo-2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1-cyano-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-[6-bromo-2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]-1-cyanoguanidine Traditional Name: 2-benzyl-1-[6-bromo-2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]-1-cyano-guanidine Formula: C22H25BrN4O4 MolecularWeight: 489.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)Br)N(C#N)C(=NCC3=CC=CC=C3)N)O)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)Br)N(C#N)C(=NCC3=CC=CC=C3)N)O)C(OC)OC

InChI

InChI=1S/C22H25BrN4O4/c1-22(20(29-2)30-3)19(28)18(16-11-15(23)9-10-17(16)31-22)27(13-24)21(25)26-12-14-7-5-4-6-8-14/h4-11,18-20,28H,12H2,1-3H3,(H2,25,26)