3-azanyl-4,5-bis(2-chloroethyl)-2-methyl-benzenecarbonitrile

Systemtic Name: 3-azanyl-4,5-bis(2-chloroethyl)-2-methyl-benzenecarbonitrile Openeye Name: 3-amino-4,5-bis(2-chloroethyl)-2-methyl-benzonitrile CAS Name: 3-amino-4,5-bis(2-chloroethyl)-2-methylbenzonitrile IUPAC Name: 3-amino-4,5-bis(2-chloroethyl)-2-methylbenzonitrile Traditional Name: 3-amino-4,5-bis(2-chloroethyl)-2-methyl-benzonitrile Formula: C12H14Cl2N2 MolecularWeight: 257.15896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C#N)CCCl)CCCl)N

Isomeric SMILES

CC1=C(C(=C(C=C1C#N)CCCl)CCCl)N

InChI

InChI=1S/C12H14Cl2N2/c1-8-10(7-15)6-9(2-4-13)11(3-5-14)12(8)16/h6H,2-5,16H2,1H3