1-[(2S)-2-ethylpiperidin-1-yl]-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[(2S)-2-ethyl-1-piperidyl]-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[(2S)-2-ethyl-1-piperidinyl]-2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[(2S)-2-ethylpiperidino]-2-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H28N4O5S/c1-2-16-6-3-4-9-22(16)19(24)15-20-10-12-21(13-11-20)29(27,28)18-8-5-7-17(14-18)23(25)26/h5,7-8,14,16H,2-4,6,9-13,15H2,1H3/t16-/m0/s1