2-[(2-methoxy-5-nitro-phenyl)amino]-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)amino]-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Openeye Name: 2-(2-methoxy-5-nitro-anilino)-1-[(2S)-2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(2-methoxy-5-nitroanilino)-1-[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-(2-methoxy-5-nitroanilino)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-(2-methoxy-5-nitro-anilino)-1-[(2S)-2-(2-thienyl)pyrrolidino]ethanone Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCCC2C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCC[C@H]2C3=CC=CS3

InChI

InChI=1S/C17H19N3O4S/c1-24-15-7-6-12(20(22)23)10-13(15)18-11-17(21)19-8-2-4-14(19)16-5-3-9-25-16/h3,5-7,9-10,14,18H,2,4,8,11H2,1H3/t14-/m0/s1