[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzoic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzoate Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCC=C)S(=O)(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCC=C)S(=O)(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C22H24N2O6S/c1-3-12-23-21(25)15-30-22(26)17-10-11-19(29-2)20(14-17)31(27,28)24-13-6-8-16-7-4-5-9-18(16)24/h3-5,7,9-11,14H,1,6,8,12-13,15H2,2H3,(H,23,25)