N-(2-chloranyl-5-nitro-phenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[4-[(E)-styryl]sulfonylpiperazino]propionamide Formula: C21H23ClN4O5S MolecularWeight: 478.94912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O5S/c1-16(21(27)23-20-15-18(26(28)29)7-8-19(20)22)24-10-12-25(13-11-24)32(30,31)14-9-17-5-3-2-4-6-17/h2-9,14-16H,10-13H2,1H3,(H,23,27)/b14-9+