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

Systemtic Name: 1-[6-azanyl-2-(1,3-dioxolan-2-yl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1-cyano-2-(phenylmethyl)guanidine Openeye Name: 1-[6-amino-2-(1,3-dioxolan-2-yl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine CAS Name: 1-[6-amino-2-(1,3-dioxolan-2-yl)-3-hydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1-cyano-2-(phenylmethyl)guanidine IUPAC Name: 1-[6-amino-2-(1,3-dioxolan-2-yl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]-2-benzyl-1-cyanoguanidine Traditional Name: 1-[6-amino-2-(1,3-dioxolan-2-yl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)N)N(C#N)C(=NCC3=CC=CC=C3)N)O)C4OCCO4

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)N)N(C#N)C(=NCC3=CC=CC=C3)N)O)C4OCCO4

InChI

InChI=1S/C22H25N5O4/c1-22(20-29-9-10-30-20)19(28)18(16-11-15(24)7-8-17(16)31-22)27(13-23)21(25)26-12-14-5-3-2-4-6-14/h2-8,11,18-20,28H,9-10,12,24H2,1H3,(H2,25,26)