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

Systemtic Name: 2-(4-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]guanidine Openeye Name: 2-(4-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]guanidine CAS Name: 2-(4-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]guanidine IUPAC Name: 2-(4-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]guanidine Traditional Name: 2-(4-chlorophenyl)-1-cyano-1-[2-(dimethoxymethyl)-3-hydroxy-2-methyl-chroman-4-yl]guanidine Formula: C21H23ClN4O4 MolecularWeight: 430.88472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC=CC=C2O1)N(C#N)C(=NC3=CC=C(C=C3)Cl)N)O)C(OC)OC

Isomeric SMILES

CC1(C(C(C2=CC=CC=C2O1)N(C#N)C(=NC3=CC=C(C=C3)Cl)N)O)C(OC)OC

InChI

InChI=1S/C21H23ClN4O4/c1-21(19(28-2)29-3)18(27)17(15-6-4-5-7-16(15)30-21)26(12-23)20(24)25-14-10-8-13(22)9-11-14/h4-11,17-19,27H,1-3H3,(H2,24,25)