4-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-nitro-benzamide

Systemtic Name: 4-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-nitro-benzamide Openeye Name: 4-[4-methyl-3-(1-piperidylsulfonyl)anilino]-3-nitro-benzamide CAS Name: 4-[4-methyl-3-(1-piperidinylsulfonyl)anilino]-3-nitrobenzamide IUPAC Name: 4-(4-methyl-3-piperidin-1-ylsulfonylanilino)-3-nitrobenzamide Traditional Name: 4-(4-methyl-3-piperidinosulfonyl-anilino)-3-nitro-benzamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H22N4O5S/c1-13-5-7-15(12-18(13)29(27,28)22-9-3-2-4-10-22)21-16-8-6-14(19(20)24)11-17(16)23(25)26/h5-8,11-12,21H,2-4,9-10H2,1H3,(H2,20,24)