N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitroimidazol-1-yl)ethanamide Openeye Name: N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitroimidazol-1-yl)acetamide CAS Name: N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitro-1-imidazolyl)acetamide IUPAC Name: N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitroimidazol-1-yl)acetamide Traditional Name: N-[4-[bis(2-chloroethyl)amino]phenyl]-2-(2-nitroimidazol-1-yl)acetamide Formula: C15H17Cl2N5O3 MolecularWeight: 386.23318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CN2C=CN=C2[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CN2C=CN=C2[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C15H17Cl2N5O3/c16-5-8-20(9-6-17)13-3-1-12(2-4-13)19-14(23)11-21-10-7-18-15(21)22(24)25/h1-4,7,10H,5-6,8-9,11H2,(H,19,23)