N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-2-(2,4-dimethyl-6-nitro-phenoxy)ethanamide

Systemtic Name: N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-2-(2,4-dimethyl-6-nitro-phenoxy)ethanamide Openeye Name: N-(3-chloro-4-pyrrolidin-1-yl-phenyl)-2-(2,4-dimethyl-6-nitro-phenoxy)acetamide CAS Name: N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-2-(2,4-dimethyl-6-nitrophenoxy)acetamide IUPAC Name: N-(3-chloro-4-pyrrolidin-1-ylphenyl)-2-(2,4-dimethyl-6-nitrophenoxy)acetamide Traditional Name: N-(3-chloro-4-pyrrolidino-phenyl)-2-(2,4-dimethyl-6-nitro-phenoxy)acetamide Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC(=C(C=C2)N3CCCC3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])OCC(=O)NC2=CC(=C(C=C2)N3CCCC3)Cl)C

InChI

InChI=1S/C20H22ClN3O4/c1-13-9-14(2)20(18(10-13)24(26)27)28-12-19(25)22-15-5-6-17(16(21)11-15)23-7-3-4-8-23/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,22,25)