N-(2-methyl-5-nitro-phenyl)-3-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-3-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-3-[2-(2-thienyl)pyrrolidin-1-yl]propanamide CAS Name: N-(2-methyl-5-nitrophenyl)-3-(2-thiophen-2-yl-1-pyrrolidinyl)propanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-3-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-3-[2-(2-thienyl)pyrrolidino]propionamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2CCCC2C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2CCCC2C3=CC=CS3

InChI

InChI=1S/C18H21N3O3S/c1-13-6-7-14(21(23)24)12-15(13)19-18(22)8-10-20-9-2-4-16(20)17-5-3-11-25-17/h3,5-7,11-12,16H,2,4,8-10H2,1H3,(H,19,22)