2-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]-1-(4-nitrophenyl)ethanol

Systemtic Name: 2-[2-azanyl-3-(4-methylphenyl)sulfonyl-pyrrolo[3,2-b]quinoxalin-1-yl]-1-(4-nitrophenyl)ethanol Openeye Name: 2-[2-amino-3-(p-tolylsulfonyl)pyrrolo[3,2-b]quinoxalin-1-yl]-1-(4-nitrophenyl)ethanol CAS Name: 2-[2-amino-3-(4-methylphenyl)sulfonyl-1-pyrrolo[3,2-b]quinoxalinyl]-1-(4-nitrophenyl)ethanol IUPAC Name: 2-[2-amino-3-(4-methylphenyl)sulfonylpyrrolo[3,2-b]quinoxalin-1-yl]-1-(4-nitrophenyl)ethanol Traditional Name: 2-(2-amino-3-tosyl-pyrrolo[3,2-b]quinoxalin-1-yl)-1-(4-nitrophenyl)ethanol Formula: C25H21N5O5S MolecularWeight: 503.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC(C5=CC=C(C=C5)[N+](=O)[O-])O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC(C5=CC=C(C=C5)[N+](=O)[O-])O)N

InChI

InChI=1S/C25H21N5O5S/c1-15-6-12-18(13-7-15)36(34,35)23-22-25(28-20-5-3-2-4-19(20)27-22)29(24(23)26)14-21(31)16-8-10-17(11-9-16)30(32)33/h2-13,21,31H,14,26H2,1H3