[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone Formula: C21H24ClN5O5S MolecularWeight: 493.96376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H24ClN5O5S/c22-17-3-4-19(20(14-17)27(29)30)24-10-12-25(13-11-24)21(28)16-5-8-26(9-6-16)33(31,32)18-2-1-7-23-15-18/h1-4,7,14-16H,5-6,8-13H2