2-[(4-nitrophenyl)methyl-(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[(4-nitrophenyl)methyl-(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[benzenesulfonyl-[(4-nitrophenyl)methyl]amino]acetic acid CAS Name: 2-[benzenesulfonyl-[(4-nitrophenyl)methyl]amino]acetic acid IUPAC Name: 2-[benzenesulfonyl-[(4-nitrophenyl)methyl]amino]acetic acid Traditional Name: 2-[besyl-(4-nitrobenzyl)amino]acetic acid Formula: C15H14N2O6S MolecularWeight: 350.34646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O

InChI

InChI=1S/C15H14N2O6S/c18-15(19)11-16(24(22,23)14-4-2-1-3-5-14)10-12-6-8-13(9-7-12)17(20)21/h1-9H,10-11H2,(H,18,19)