2-[4-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]piperidin-1-yl]ethanamide

Systemtic Name: 2-[4-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]piperidin-1-yl]ethanamide Openeye Name: 2-[4-[4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]-1-piperidyl]acetamide CAS Name: 2-[4-[4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]-1-piperidinyl]acetamide IUPAC Name: 2-[4-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]piperidin-1-yl]acetamide Traditional Name: 2-[4-[4-(3-methylpiperidino)sulfonyl-2-nitro-anilino]piperidino]acetamide Formula: C19H29N5O5S MolecularWeight: 439.52906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCN(CC3)CC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCN(CC3)CC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H29N5O5S/c1-14-3-2-8-23(12-14)30(28,29)16-4-5-17(18(11-16)24(26)27)21-15-6-9-22(10-7-15)13-19(20)25/h4-5,11,14-15,21H,2-3,6-10,12-13H2,1H3,(H2,20,25)