3-[bis(2-chloroethyl)aminomethyl]-4-nitro-phenol

Systemtic Name: 3-[bis(2-chloroethyl)aminomethyl]-4-nitro-phenol Openeye Name: 3-[bis(2-chloroethyl)aminomethyl]-4-nitro-phenol CAS Name: 3-[bis(2-chloroethyl)aminomethyl]-4-nitrophenol IUPAC Name: 3-[bis(2-chloroethyl)aminomethyl]-4-nitrophenol Traditional Name: 3-[bis(2-chloroethyl)aminomethyl]-4-nitro-phenol Formula: C11H14Cl2N2O3 MolecularWeight: 293.14646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)CN(CCCl)CCCl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1O)CN(CCCl)CCCl)[N+](=O)[O-]

InChI

InChI=1S/C11H14Cl2N2O3/c12-3-5-14(6-4-13)8-9-7-10(16)1-2-11(9)15(17)18/h1-2,7,16H,3-6,8H2