N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-3-methyl-2-nitro-benzamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-3-methyl-2-nitro-benzamide Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O5S/c1-4-25(5-2)21-13-12-18(33(31,32)26-14-7-6-8-15-26)16-20(21)24-23(28)19-11-9-10-17(3)22(19)27(29)30/h9-13,16H,4-8,14-15H2,1-3H3,(H,24,28)