2-(2-chloranyl-4-nitro-phenoxy)-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-N-[3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-(2-chloro-4-nitrophenoxy)-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-N-(3-piperidinosulfonylphenyl)propionamide Formula: C20H22ClN3O6S MolecularWeight: 467.92318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H22ClN3O6S/c1-14(30-19-9-8-16(24(26)27)13-18(19)21)20(25)22-15-6-5-7-17(12-15)31(28,29)23-10-3-2-4-11-23/h5-9,12-14H,2-4,10-11H2,1H3,(H,22,25)