4-(6-chloranyl-3-methanoyl-2-nitro-phenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butanamide

Systemtic Name: 4-(6-chloranyl-3-methanoyl-2-nitro-phenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butanamide Openeye Name: 4-(6-chloro-3-formyl-2-nitro-phenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butanamide CAS Name: 4-(6-chloro-3-formyl-2-nitrophenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butanamide IUPAC Name: 4-(6-chloro-3-formyl-2-nitrophenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butanamide Traditional Name: 4-(6-chloro-3-formyl-2-nitro-phenoxy)-N-(1-cyclopentylbutyl)-N-(1-hydroxyethyl)butyramide Formula: C22H31ClN2O6 MolecularWeight: 454.94434

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCC1)N(C(C)O)C(=O)CCCOC2=C(C=CC(=C2[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CCCC(C1CCCC1)N(C(C)O)C(=O)CCCOC2=C(C=CC(=C2[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C22H31ClN2O6/c1-3-7-19(16-8-4-5-9-16)24(15(2)27)20(28)10-6-13-31-22-18(23)12-11-17(14-26)21(22)25(29)30/h11-12,14-16,19,27H,3-10,13H2,1-2H3