2-[4-[[4-(azepan-1-yl)-6-methyl-1,3,5-triazin-2-yl]oxy]-3-bromanyl-5-methoxy-phenyl]propan-2-ol

Systemtic Name: 2-[4-[[4-(azepan-1-yl)-6-methyl-1,3,5-triazin-2-yl]oxy]-3-bromanyl-5-methoxy-phenyl]propan-2-ol Openeye Name: 2-[4-[[4-(azepan-1-yl)-6-methyl-1,3,5-triazin-2-yl]oxy]-3-bromo-5-methoxy-phenyl]propan-2-ol CAS Name: 2-[4-[[4-(1-azepanyl)-6-methyl-1,3,5-triazin-2-yl]oxy]-3-bromo-5-methoxyphenyl]-2-propanol IUPAC Name: 2-[4-[[4-(azepan-1-yl)-6-methyl-1,3,5-triazin-2-yl]oxy]-3-bromo-5-methoxyphenyl]propan-2-ol Traditional Name: 2-[4-[[4-(azepan-1-yl)-6-methyl-s-triazin-2-yl]oxy]-3-bromo-5-methoxy-phenyl]propan-2-ol Formula: C20H27BrN4O3 MolecularWeight: 451.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrN4O3/c1-13-22-18(25-9-7-5-6-8-10-25)24-19(23-13)28-17-15(21)11-14(20(2,3)26)12-16(17)27-4/h11-12,26H,5-10H2,1-4H3