(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C26H21ClN2O7S MolecularWeight: 540.97214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)OCCO5)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)OCCO5)Cl

InChI

InChI=1S/C26H21ClN2O7S/c1-33-20-7-4-17-12-18(25(27)28-22(17)13-20)15-36-26(30)16-2-5-19(6-3-16)29-37(31,32)21-8-9-23-24(14-21)35-11-10-34-23/h2-9,12-14,29H,10-11,15H2,1H3