cyanomethyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate

Systemtic Name: cyanomethyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate Openeye Name: cyanomethyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoate CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxybenzoate Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-benzoic acid cyanomethyl ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O5S/c1-25-17-9-8-15(19(22)26-12-10-20)13-18(17)27(23,24)21-11-4-6-14-5-2-3-7-16(14)21/h2-3,5,7-9,13H,4,6,11-12H2,1H3