4-(4-bromanyl-2,6-dimethyl-phenoxy)-3-methyl-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)butan-1-ol

Systemtic Name: 4-(4-bromanyl-2,6-dimethyl-phenoxy)-3-methyl-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)butan-1-ol Openeye Name: 4-(4-bromo-2,6-dimethyl-phenoxy)-3-methyl-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)butan-1-ol CAS Name: 4-(4-bromo-2,6-dimethylphenoxy)-3-methyl-4-(6-methyl-1-pyrrolo[3,2-c]pyridinyl)-1-butanol IUPAC Name: 4-(4-bromo-2,6-dimethylphenoxy)-3-methyl-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)butan-1-ol Traditional Name: 4-(4-bromo-2,6-dimethyl-phenoxy)-3-methyl-4-(6-methylpyrrolo[3,2-c]pyridin-1-yl)butan-1-ol Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C(C)CCO)N2C=CC3=CN=C(C=C32)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(C(C)CCO)N2C=CC3=CN=C(C=C32)C)C)Br

InChI

InChI=1S/C21H25BrN2O2/c1-13(6-8-25)21(26-20-14(2)9-18(22)10-15(20)3)24-7-5-17-12-23-16(4)11-19(17)24/h5,7,9-13,21,25H,6,8H2,1-4H3