5-(dibenzo-p-dioxin-2-ylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-(dibenzo-p-dioxin-2-ylmethyl)pyrimidine-2,4-diamine Openeye Name: 5-(dibenzo-p-dioxin-2-ylmethyl)pyrimidine-2,4-diamine CAS Name: 5-(2-dibenzo-p-dioxinylmethyl)pyrimidine-2,4-diamine IUPAC Name: 5-(dibenzo-p-dioxin-2-ylmethyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(dibenzo-p-dioxin-2-ylmethyl)pyrimidin-4-yl]amine Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(O2)C=C(C=C3)CC4=CN=C(N=C4N)N

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(O2)C=C(C=C3)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C17H14N4O2/c18-16-11(9-20-17(19)21-16)7-10-5-6-14-15(8-10)23-13-4-2-1-3-12(13)22-14/h1-6,8-9H,7H2,(H4,18,19,20,21)