N-[(3-fluorophenyl)methyl]-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-methyl-propanamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-methyl-propanamide Openeye Name: N-[(3-fluorophenyl)methyl]-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-methyl-propanamide CAS Name: N-[(3-fluorophenyl)methyl]-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-N-methylpropanamide IUPAC Name: N-[(3-fluorophenyl)methyl]-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-N-methylpropanamide Traditional Name: N-(3-fluorobenzyl)-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-N-methyl-propionamide Formula: C22H27FN4O6S MolecularWeight: 494.536383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC(=CC=C1)F)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N(C)CC1=CC(=CC=C1)F)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H27FN4O6S/c1-16(22(28)24(2)15-17-5-4-6-18(23)13-17)25-9-11-26(12-10-25)34(31,32)19-7-8-21(33-3)20(14-19)27(29)30/h4-8,13-14,16H,9-12,15H2,1-3H3