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

Systemtic Name: 2-[(2-chlorophenyl)methyl]-1-cyano-3-[2-(dimethoxymethyl)-2-methyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]guanidine Openeye Name: 2-[(2-chlorophenyl)methyl]-1-cyano-3-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-chroman-4-yl]guanidine CAS Name: 2-[(2-chlorophenyl)methyl]-1-cyano-3-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]guanidine IUPAC Name: 2-[(2-chlorophenyl)methyl]-1-cyano-3-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-3,4-dihydrochromen-4-yl]guanidine Traditional Name: 2-(2-chlorobenzyl)-1-cyano-3-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-6-nitro-chroman-4-yl]guanidine Formula: C22H24ClN5O6 MolecularWeight: 489.90886

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NC(=NCC3=CC=CC=C3Cl)NC#N)O)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NC(=NCC3=CC=CC=C3Cl)NC#N)O)C(OC)OC

InChI

InChI=1S/C22H24ClN5O6/c1-22(20(32-2)33-3)19(29)18(15-10-14(28(30)31)8-9-17(15)34-22)27-21(26-12-24)25-11-13-6-4-5-7-16(13)23/h4-10,18-20,29H,11H2,1-3H3,(H2,25,26,27)