2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-[(1S)-1-phenylethyl]ethanamide

Systemtic Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-[(1S)-1-phenylethyl]ethanamide Openeye Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-[(1S)-1-phenylethyl]acetamide CAS Name: 2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-N-[(1S)-1-phenylethyl]acetamide IUPAC Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-N-[(1S)-1-phenylethyl]acetamide Traditional Name: 2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)-N-[(1S)-1-phenylethyl]acetamide Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-15(16-7-3-2-4-8-16)21-20(24)14-29-19-10-9-17(13-18(19)23(25)26)30(27,28)22-11-5-6-12-22/h2-4,7-10,13,15H,5-6,11-12,14H2,1H3,(H,21,24)/t15-/m0/s1