N,N-bis(2-chloroethyl)-3-methyl-4-nitro-aniline

Systemtic Name: N,N-bis(2-chloroethyl)-3-methyl-4-nitro-aniline Openeye Name: N,N-bis(2-chloroethyl)-3-methyl-4-nitro-aniline CAS Name: N,N-bis(2-chloroethyl)-3-methyl-4-nitroaniline IUPAC Name: N,N-bis(2-chloroethyl)-3-methyl-4-nitroaniline Traditional Name: bis(2-chloroethyl)-(3-methyl-4-nitro-phenyl)amine Formula: C11H14Cl2N2O2 MolecularWeight: 277.14706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCCl)CCCl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCCl)CCCl)[N+](=O)[O-]

InChI

InChI=1S/C11H14Cl2N2O2/c1-9-8-10(2-3-11(9)15(16)17)14(6-4-12)7-5-13/h2-3,8H,4-7H2,1H3