2-(2-methoxyethylamino)-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-5-nitro-benzamide

Systemtic Name: 2-(2-methoxyethylamino)-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-5-nitro-benzamide Openeye Name: 2-(2-methoxyethylamino)-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-5-nitro-benzamide CAS Name: 2-(2-methoxyethylamino)-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-5-nitrobenzamide IUPAC Name: 2-(2-methoxyethylamino)-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-5-nitrobenzamide Traditional Name: 2-(2-methoxyethylamino)-N-[4-(3-methylpiperidino)sulfonylphenyl]-5-nitro-benzamide Formula: C22H28N4O6S MolecularWeight: 476.54592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NCCOC

InChI

InChI=1S/C22H28N4O6S/c1-16-4-3-12-25(15-16)33(30,31)19-8-5-17(6-9-19)24-22(27)20-14-18(26(28)29)7-10-21(20)23-11-13-32-2/h5-10,14,16,23H,3-4,11-13,15H2,1-2H3,(H,24,27)