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

Systemtic Name: (1-methyl-5-nitro-imidazol-2-yl)methyl N-[4-[bis(2-hydroxyethyl)amino]phenyl]carbamate Openeye Name: (1-methyl-5-nitro-imidazol-2-yl)methyl N-[4-[bis(2-hydroxyethyl)amino]phenyl]carbamate CAS Name: N-[4-[bis(2-hydroxyethyl)amino]phenyl]carbamic acid (1-methyl-5-nitro-2-imidazolyl)methyl ester IUPAC Name: (1-methyl-5-nitroimidazol-2-yl)methyl N-[4-[bis(2-hydroxyethyl)amino]phenyl]carbamate Traditional Name: N-[4-[bis(2-hydroxyethyl)amino]phenyl]carbamic acid (1-methyl-5-nitro-imidazol-2-yl)methyl ester Formula: C16H21N5O6 MolecularWeight: 379.36784

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)NC2=CC=C(C=C2)N(CCO)CCO)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1COC(=O)NC2=CC=C(C=C2)N(CCO)CCO)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O6/c1-19-14(17-10-15(19)21(25)26)11-27-16(24)18-12-2-4-13(5-3-12)20(6-8-22)7-9-23/h2-5,10,22-23H,6-9,11H2,1H3,(H,18,24)