N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-4-ethoxy-3-nitro-benzamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-4-ethoxy-3-nitro-benzamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-4-ethoxy-3-nitrobenzamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-4-ethoxy-3-nitro-benzamide Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O4/c1-2-27-17-9-8-13(12-16(17)23(25)26)19(24)21-15-7-5-6-14(20)18(15)22-10-3-4-11-22/h5-9,12H,2-4,10-11H2,1H3,(H,21,24)