(E)-3-(6-chloranyl-2H-chromen-3-yl)-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(6-chloranyl-2H-chromen-3-yl)-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(6-chloro-2H-chromen-3-yl)-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(6-chloro-2H-1-benzopyran-3-yl)-1-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(6-chloro-2H-chromen-3-yl)-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(6-chloro-2H-chromen-3-yl)-1-(4-nosylpiperazino)prop-2-en-1-one Formula: C22H20ClN3O6S MolecularWeight: 489.9287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC3=C(C=CC(=C3)Cl)OC2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC3=C(C=CC(=C3)Cl)OC2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O6S/c23-18-2-7-21-17(14-18)13-16(15-32-21)1-8-22(27)24-9-11-25(12-10-24)33(30,31)20-5-3-19(4-6-20)26(28)29/h1-8,13-14H,9-12,15H2/b8-1+