propyl 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]benzoate

Systemtic Name: propyl 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]benzoate Openeye Name: propyl 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate CAS Name: 4-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate Traditional Name: 4-[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoic acid propyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C21H24N2O5S/c1-3-13-28-21(25)15-6-9-18(10-7-15)22-20(24)17-8-11-19-16(14-17)5-4-12-23(19)29(2,26)27/h6-11,14H,3-5,12-13H2,1-2H3,(H,22,24)