N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-3-(2-nitroanilino)propanamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-3-(2-nitroanilino)propanamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-3-(2-nitroanilino)propionamide Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C20H23ClN4O5S/c21-16-9-8-15(14-19(16)31(29,30)24-12-4-1-5-13-24)23-20(26)10-11-22-17-6-2-3-7-18(17)25(27)28/h2-3,6-9,14,22H,1,4-5,10-13H2,(H,23,26)