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

Systemtic Name: 2-[4-[[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]amino]piperidin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[4-[(3-methyl-1-piperidyl)sulfonyl]-2-nitro-anilino]-1-piperidyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[4-[(3-methyl-1-piperidinyl)sulfonyl]-2-nitroanilino]-1-piperidinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[4-(3-methylpiperidin-1-yl)sulfonyl-2-nitroanilino]piperidin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[4-(3-methylpiperidino)sulfonyl-2-nitro-anilino]piperidino]-1-pyrrolidino-ethanone Formula: C23H35N5O5S MolecularWeight: 493.6195

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCN(CC3)CC(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC3CCN(CC3)CC(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H35N5O5S/c1-18-5-4-12-27(16-18)34(32,33)20-6-7-21(22(15-20)28(30)31)24-19-8-13-25(14-9-19)17-23(29)26-10-2-3-11-26/h6-7,15,18-19,24H,2-5,8-14,16-17H2,1H3