N-[1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-yl]-3-phenyl-propanamide

Systemtic Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-yl]-3-phenyl-propanamide Openeye Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonyl-4-piperidyl]-3-phenyl-propanamide CAS Name: N-[1-(2-methoxy-5-nitrophenyl)sulfonyl-4-piperidinyl]-3-phenylpropanamide IUPAC Name: N-[1-(2-methoxy-5-nitrophenyl)sulfonylpiperidin-4-yl]-3-phenylpropanamide Traditional Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonyl-4-piperidyl]-3-phenyl-propionamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)NC(=O)CCC3=CC=CC=C3

InChI

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