[4-(2-nitrophenyl)piperazin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone

Systemtic Name: [4-(2-nitrophenyl)piperazin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone Openeye Name: [4-(2-nitrophenyl)piperazin-1-yl]-(1-propylsulfonyl-3-piperidyl)methanone CAS Name: [4-(2-nitrophenyl)-1-piperazinyl]-(1-propylsulfonyl-3-piperidinyl)methanone IUPAC Name: [4-(2-nitrophenyl)piperazin-1-yl]-(1-propylsulfonylpiperidin-3-yl)methanone Traditional Name: [4-(2-nitrophenyl)piperazino]-(1-propylsulfonyl-3-piperidyl)methanone Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H28N4O5S/c1-2-14-29(27,28)22-9-5-6-16(15-22)19(24)21-12-10-20(11-13-21)17-7-3-4-8-18(17)23(25)26/h3-4,7-8,16H,2,5-6,9-15H2,1H3