(4-chloranylnaphthalen-1-yl) 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (4-chloranylnaphthalen-1-yl) 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (4-chloro-1-naphthyl) 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetic acid (4-chloro-1-naphthalenyl) ester IUPAC Name: (4-chloronaphthalen-1-yl) 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetic acid (4-chloro-1-naphthyl) ester Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC2=CC=C(C3=CC=CC=C32)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC2=CC=C(C3=CC=CC=C32)Cl

InChI

InChI=1S/C21H19ClN2O5S/c1-14(25)23-15-7-9-16(10-8-15)30(27,28)24(2)13-21(26)29-20-12-11-19(22)17-5-3-4-6-18(17)20/h3-12H,13H2,1-2H3,(H,23,25)