3-[(5-bromanyl-2-methyl-phenyl)amino]-2-methyl-propanenitrile

Systemtic Name: 3-[(5-bromanyl-2-methyl-phenyl)amino]-2-methyl-propanenitrile Openeye Name: 3-(5-bromo-2-methyl-anilino)-2-methyl-propanenitrile CAS Name: 3-(5-bromo-2-methylanilino)-2-methylpropanenitrile IUPAC Name: 3-(5-bromo-2-methylanilino)-2-methylpropanenitrile Traditional Name: 3-(5-bromo-2-methyl-anilino)-2-methyl-propionitrile Formula: C11H13BrN2 MolecularWeight: 253.13832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)NCC(C)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)Br)NCC(C)C#N

InChI

InChI=1S/C11H13BrN2/c1-8(6-13)7-14-11-5-10(12)4-3-9(11)2/h3-5,8,14H,7H2,1-2H3