quinolin-8-ylmethyl 2-[[2,6-bis(chloranyl)phenyl]sulfonylamino]-3-methyl-butanoate

Systemtic Name: quinolin-8-ylmethyl 2-[[2,6-bis(chloranyl)phenyl]sulfonylamino]-3-methyl-butanoate Openeye Name: 8-quinolylmethyl 2-[(2,6-dichlorophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(2,6-dichlorophenyl)sulfonylamino]-3-methylbutanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 2-[(2,6-dichlorophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[(2,6-dichlorophenyl)sulfonylamino]-3-methyl-butyric acid 8-quinolylmethyl ester Formula: C21H20Cl2N2O4S MolecularWeight: 467.3655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC2=C1N=CC=C2)NS(=O)(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC2=C1N=CC=C2)NS(=O)(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O4S/c1-13(2)18(25-30(27,28)20-16(22)9-4-10-17(20)23)21(26)29-12-15-7-3-6-14-8-5-11-24-19(14)15/h3-11,13,18,25H,12H2,1-2H3