N-[[4-(2-chloranyl-4-cyano-1-methyl-pyrrol-3-yl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-pyridin-2-yl)propanamide

Systemtic Name: N-[[4-(2-chloranyl-4-cyano-1-methyl-pyrrol-3-yl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-pyridin-2-yl)propanamide Openeye Name: N-[[4-(2-chloro-4-cyano-1-methyl-pyrrol-3-yl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-2-pyridyl)propanamide CAS Name: N-[[4-(2-chloro-4-cyano-1-methyl-3-pyrrolyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-2-pyridinyl)propanamide IUPAC Name: N-[[4-(2-chloro-4-cyano-1-methylpyrrol-3-yl)phenyl]methyl]-N-(4,6-dimethyl-3-nitropyridin-2-yl)propanamide Traditional Name: N-[4-(2-chloro-4-cyano-1-methyl-pyrrol-3-yl)benzyl]-N-(4,6-dimethyl-3-nitro-2-pyridyl)propionamide Formula: C23H22ClN5O3 MolecularWeight: 451.90548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=CC=C(C=C1)C2=C(N(C=C2C#N)C)Cl)C3=C(C(=CC(=N3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N(CC1=CC=C(C=C1)C2=C(N(C=C2C#N)C)Cl)C3=C(C(=CC(=N3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H22ClN5O3/c1-5-19(30)28(23-21(29(31)32)14(2)10-15(3)26-23)12-16-6-8-17(9-7-16)20-18(11-25)13-27(4)22(20)24/h6-10,13H,5,12H2,1-4H3