ethyl 2-[(8-chloranylnaphthalen-1-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[(8-chloranylnaphthalen-1-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(8-chloro-1-naphthyl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(8-chloro-1-naphthalenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(8-chloronaphthalen-1-yl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[(8-chloro-1-naphthyl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C25H29ClN2O6S2 MolecularWeight: 553.09056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C25H29ClN2O6S2/c1-3-34-25(29)22(11-4-5-17-27-35(30,31)20-15-13-18(2)14-16-20)28-36(32,33)23-12-7-9-19-8-6-10-21(26)24(19)23/h6-10,12-16,22,27-28H,3-5,11,17H2,1-2H3