N-[4-[(2-butyl-5-nitro-1-benzofuran-3-yl)carbonyl]phenyl]-4-chloranyl-butanamide

Systemtic Name: N-[4-[(2-butyl-5-nitro-1-benzofuran-3-yl)carbonyl]phenyl]-4-chloranyl-butanamide Openeye Name: N-[4-(2-butyl-5-nitro-benzofuran-3-carbonyl)phenyl]-4-chloro-butanamide CAS Name: N-[4-[(2-butyl-5-nitro-3-benzofuranyl)-oxomethyl]phenyl]-4-chlorobutanamide IUPAC Name: N-[4-(2-butyl-5-nitro-1-benzofuran-3-carbonyl)phenyl]-4-chlorobutanamide Traditional Name: N-[4-(2-butyl-5-nitro-benzofuran-3-carbonyl)phenyl]-4-chloro-butyramide Formula: C23H23ClN2O5 MolecularWeight: 442.89212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)NC(=O)CCCCl

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)NC(=O)CCCCl

InChI

InChI=1S/C23H23ClN2O5/c1-2-3-5-20-22(18-14-17(26(29)30)11-12-19(18)31-20)23(28)15-7-9-16(10-8-15)25-21(27)6-4-13-24/h7-12,14H,2-6,13H2,1H3,(H,25,27)