methyl 4-cyclohepta-2,5-dien-1-yl-4-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: methyl 4-cyclohepta-2,5-dien-1-yl-4-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: methyl 4-cyclohepta-2,5-dien-1-yl-4-(p-tolylsulfonylamino)butanoate CAS Name: 4-(1-cyclohepta-2,5-dienyl)-4-[(4-methylphenyl)sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 4-cyclohepta-2,5-dien-1-yl-4-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 4-cyclohepta-2,5-dien-1-yl-4-(tosylamino)butyric acid methyl ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)OC)C2CC=CCC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)OC)C2CC=CCC=C2

InChI

InChI=1S/C19H25NO4S/c1-15-9-11-17(12-10-15)25(22,23)20-18(13-14-19(21)24-2)16-7-5-3-4-6-8-16/h3,5-6,8-12,16,18,20H,4,7,13-14H2,1-2H3