1-[4-(2-bromanyl-6-methoxy-4-prop-1-en-2-yl-phenoxy)-6-methyl-1,3,5-triazin-2-yl]azepane

Systemtic Name: 1-[4-(2-bromanyl-6-methoxy-4-prop-1-en-2-yl-phenoxy)-6-methyl-1,3,5-triazin-2-yl]azepane Openeye Name: 1-[4-(2-bromo-4-isopropenyl-6-methoxy-phenoxy)-6-methyl-1,3,5-triazin-2-yl]azepane CAS Name: 1-[4-[2-bromo-6-methoxy-4-(1-methylethenyl)phenoxy]-6-methyl-1,3,5-triazin-2-yl]azepane IUPAC Name: 1-[4-(2-bromo-6-methoxy-4-prop-1-en-2-ylphenoxy)-6-methyl-1,3,5-triazin-2-yl]azepane Traditional Name: 1-[4-(2-bromo-4-isopropenyl-6-methoxy-phenoxy)-6-methyl-s-triazin-2-yl]azepane Formula: C20H25BrN4O2 MolecularWeight: 433.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC2=C(C=C(C=C2Br)C(=C)C)OC)N3CCCCCC3

Isomeric SMILES

CC1=NC(=NC(=N1)OC2=C(C=C(C=C2Br)C(=C)C)OC)N3CCCCCC3

InChI

InChI=1S/C20H25BrN4O2/c1-13(2)15-11-16(21)18(17(12-15)26-4)27-20-23-14(3)22-19(24-20)25-9-7-5-6-8-10-25/h11-12H,1,5-10H2,2-4H3