N-(2-chloranyl-5-nitro-phenyl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[2-(2-thienyl)pyrrolidin-1-yl]propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-(2-thiophen-2-yl-1-pyrrolidinyl)propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[2-(2-thienyl)pyrrolidino]propionamide Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCCC2C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCCC2C3=CC=CS3

InChI

InChI=1S/C17H18ClN3O3S/c1-11(20-8-2-4-15(20)16-5-3-9-25-16)17(22)19-14-10-12(21(23)24)6-7-13(14)18/h3,5-7,9-11,15H,2,4,8H2,1H3,(H,19,22)