ethyl 2-[(2-methyl-4-nitro-naphthalen-1-yl)-(phenylsulfonyl)amino]ethanoate

Systemtic Name: ethyl 2-[(2-methyl-4-nitro-naphthalen-1-yl)-(phenylsulfonyl)amino]ethanoate Openeye Name: ethyl 2-[benzenesulfonyl-(2-methyl-4-nitro-1-naphthyl)amino]acetate CAS Name: 2-[benzenesulfonyl-(2-methyl-4-nitro-1-naphthalenyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzenesulfonyl-(2-methyl-4-nitronaphthalen-1-yl)amino]acetate Traditional Name: 2-[besyl-(2-methyl-4-nitro-1-naphthyl)amino]acetic acid ethyl ester Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O6S/c1-3-29-20(24)14-22(30(27,28)16-9-5-4-6-10-16)21-15(2)13-19(23(25)26)17-11-7-8-12-18(17)21/h4-13H,3,14H2,1-2H3