ethyl 2-[(2,4-dinitronaphthalen-1-yl)-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[(2,4-dinitronaphthalen-1-yl)-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: ethyl 2-[(2,4-dinitro-1-naphthyl)-(p-tolylsulfonyl)amino]acetate CAS Name: 2-[(2,4-dinitro-1-naphthalenyl)-(4-methylphenyl)sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2,4-dinitronaphthalen-1-yl)-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[(2,4-dinitro-1-naphthyl)-tosyl-amino]acetic acid ethyl ester Formula: C21H19N3O8S MolecularWeight: 473.45586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)CN(C1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H19N3O8S/c1-3-32-20(25)13-22(33(30,31)15-10-8-14(2)9-11-15)21-17-7-5-4-6-16(17)18(23(26)27)12-19(21)24(28)29/h4-12H,3,13H2,1-2H3