N-[[4-(4-bromanyl-2-cyano-pyrrol-1-yl)phenyl]methyl]-N-(6-methoxy-3-nitro-pyridin-2-yl)pentanamide

Systemtic Name: N-[[4-(4-bromanyl-2-cyano-pyrrol-1-yl)phenyl]methyl]-N-(6-methoxy-3-nitro-pyridin-2-yl)pentanamide Openeye Name: N-[[4-(4-bromo-2-cyano-pyrrol-1-yl)phenyl]methyl]-N-(6-methoxy-3-nitro-2-pyridyl)pentanamide CAS Name: N-[[4-(4-bromo-2-cyano-1-pyrrolyl)phenyl]methyl]-N-(6-methoxy-3-nitro-2-pyridinyl)pentanamide IUPAC Name: N-[[4-(4-bromo-2-cyanopyrrol-1-yl)phenyl]methyl]-N-(6-methoxy-3-nitropyridin-2-yl)pentanamide Traditional Name: N-[4-(4-bromo-2-cyano-pyrrol-1-yl)benzyl]-N-(6-methoxy-3-nitro-2-pyridyl)valeramide Formula: C23H22BrN5O4 MolecularWeight: 512.35588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=C(C=C1)N2C=C(C=C2C#N)Br)C3=C(C=CC(=N3)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)N(CC1=CC=C(C=C1)N2C=C(C=C2C#N)Br)C3=C(C=CC(=N3)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H22BrN5O4/c1-3-4-5-22(30)28(23-20(29(31)32)10-11-21(26-23)33-2)14-16-6-8-18(9-7-16)27-15-17(24)12-19(27)13-25/h6-12,15H,3-5,14H2,1-2H3