(1-methyl-5-nitro-imidazol-2-yl) N-[4-[bis(2-chloroethyl)amino]phenyl]carbamate

Systemtic Name: (1-methyl-5-nitro-imidazol-2-yl) N-[4-[bis(2-chloroethyl)amino]phenyl]carbamate Openeye Name: (1-methyl-5-nitro-imidazol-2-yl) N-[4-[bis(2-chloroethyl)amino]phenyl]carbamate CAS Name: N-[4-[bis(2-chloroethyl)amino]phenyl]carbamic acid (1-methyl-5-nitro-2-imidazolyl) ester IUPAC Name: (1-methyl-5-nitroimidazol-2-yl) N-[4-[bis(2-chloroethyl)amino]phenyl]carbamate Traditional Name: N-[4-[bis(2-chloroethyl)amino]phenyl]carbamic acid (1-methyl-5-nitro-imidazol-2-yl) ester Formula: C15H17Cl2N5O4 MolecularWeight: 402.23258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1OC(=O)NC2=CC=C(C=C2)N(CCCl)CCCl)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1OC(=O)NC2=CC=C(C=C2)N(CCCl)CCCl)[N+](=O)[O-]

InChI

InChI=1S/C15H17Cl2N5O4/c1-20-13(22(24)25)10-18-14(20)26-15(23)19-11-2-4-12(5-3-11)21(8-6-16)9-7-17/h2-5,10H,6-9H2,1H3,(H,19,23)