2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate

Systemtic Name: 2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate Openeye Name: 2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl N-[4-(diethylamino)-2-methyl-phenyl]carbamate CAS Name: N-[4-(diethylamino)-2-methylphenyl]carbamic acid 2-(1-methyl-5-nitro-2-benzimidazolyl)ethyl ester IUPAC Name: 2-(1-methyl-5-nitrobenzimidazol-2-yl)ethyl N-[4-(diethylamino)-2-methylphenyl]carbamate Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]carbamic acid 2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl ester Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)OCCC2=NC3=C(N2C)C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)OCCC2=NC3=C(N2C)C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H27N5O4/c1-5-26(6-2)16-7-9-18(15(3)13-16)24-22(28)31-12-11-21-23-19-14-17(27(29)30)8-10-20(19)25(21)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,24,28)