N-[4-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide

Systemtic Name: N-[4-[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide Openeye Name: N-[3-acetyl-4-[2-(4-chloro-3-nitro-anilino)-2-oxo-ethoxy]phenyl]butanamide CAS Name: N-[3-acetyl-4-[2-(4-chloro-3-nitroanilino)-2-oxoethoxy]phenyl]butanamide IUPAC Name: N-[3-acetyl-4-[2-(4-chloro-3-nitroanilino)-2-oxoethoxy]phenyl]butanamide Traditional Name: N-[3-acetyl-4-[2-(4-chloro-3-nitro-anilino)-2-keto-ethoxy]phenyl]butyramide Formula: C20H20ClN3O6 MolecularWeight: 433.8423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C20H20ClN3O6/c1-3-4-19(26)22-13-6-8-18(15(9-13)12(2)25)30-11-20(27)23-14-5-7-16(21)17(10-14)24(28)29/h5-10H,3-4,11H2,1-2H3,(H,22,26)(H,23,27)