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

Systemtic Name: 1-[6-azanyl-2-(1,3-dioxan-2-yl)-2-methyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1-cyano-2-(phenylmethyl)guanidine Openeye Name: 1-[6-amino-2-(1,3-dioxan-2-yl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine CAS Name: 1-[6-amino-2-(1,3-dioxan-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-dioxan-2-yl)-3-hydroxy-2-methyl-3,4-dihydrochromen-4-yl]-2-benzyl-1-cyanoguanidine Traditional Name: 1-[6-amino-2-(1,3-dioxan-2-yl)-3-hydroxy-2-methyl-chroman-4-yl]-2-benzyl-1-cyano-guanidine Formula: C23H27N5O4 MolecularWeight: 437.49158

Click to see the large picture

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)C4OCCCO4

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)N)N(C#N)C(=NCC3=CC=CC=C3)N)O)C4OCCCO4

InChI

InChI=1S/C23H27N5O4/c1-23(21-30-10-5-11-31-21)20(29)19(17-12-16(25)8-9-18(17)32-23)28(14-24)22(26)27-13-15-6-3-2-4-7-15/h2-4,6-9,12,19-21,29H,5,10-11,13,25H2,1H3,(H2,26,27)