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

Systemtic Name: N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-2-nitro-benzamide Openeye Name: N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-2-nitro-benzamide CAS Name: N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-2-nitrobenzamide IUPAC Name: N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-2-nitrobenzamide Traditional Name: N-[4-(3-methylpiperidino)sulfonylphenyl]-2-nitro-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-14-5-4-12-21(13-14)28(26,27)16-10-8-15(9-11-16)20-19(23)17-6-2-3-7-18(17)22(24)25/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,20,23)