N-[4-[1-[2-(4-nitrophenoxy)ethyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[1-[2-(4-nitrophenoxy)ethyl]piperidin-4-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[1-[2-(4-nitrophenoxy)ethyl]piperidine-4-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[1-[2-(4-nitrophenoxy)ethyl]-4-piperidinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[1-[2-(4-nitrophenoxy)ethyl]piperidine-4-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-[1-[2-(4-nitrophenoxy)ethyl]isonipecotoyl]phenyl]methanesulfonamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)C2CCN(CC2)CCOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O6S/c1-31(28,29)22-18-4-2-16(3-5-18)21(25)17-10-12-23(13-11-17)14-15-30-20-8-6-19(7-9-20)24(26)27/h2-9,17,22H,10-15H2,1H3