2-[[4-[(6Z)-6-(iodanylmethylidene)-2-oxidanylidene-oxan-3-yl]phenyl]methyl]guanidine

Systemtic Name: 2-[[4-[(6Z)-6-(iodanylmethylidene)-2-oxidanylidene-oxan-3-yl]phenyl]methyl]guanidine Openeye Name: 2-[[4-[(6Z)-6-(iodomethylene)-2-oxo-tetrahydropyran-3-yl]phenyl]methyl]guanidine CAS Name: 2-[[4-[(6Z)-6-(iodomethylidene)-2-oxo-3-oxanyl]phenyl]methyl]guanidine IUPAC Name: 2-[[4-[(6Z)-6-(iodomethylidene)-2-oxooxan-3-yl]phenyl]methyl]guanidine Traditional Name: 2-[4-[(6Z)-6-(iodomethylene)-2-keto-tetrahydropyran-3-yl]benzyl]guanidine Formula: C14H16IN3O2 MolecularWeight: 385.20021

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CI)OC(=O)C1C2=CC=C(C=C2)CN=C(N)N

Isomeric SMILES

C1C/C(=C/I)/OC(=O)C1C2=CC=C(C=C2)CN=C(N)N

InChI

InChI=1S/C14H16IN3O2/c15-7-11-5-6-12(13(19)20-11)10-3-1-9(2-4-10)8-18-14(16)17/h1-4,7,12H,5-6,8H2,(H4,16,17,18)/b11-7-