(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[[(E)-2-phenylethenyl]sulfonylamino]ethanoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[[(E)-2-phenylethenyl]sulfonylamino]ethanoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-[[(E)-styryl]sulfonylamino]acetate CAS Name: 2-[[(E)-2-phenylethenyl]sulfonylamino]acetic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate Traditional Name: 2-[[(E)-styryl]sulfonylamino]acetic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNS(=O)(=O)C=CC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNS(=O)(=O)/C=C/C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O5S/c1-28-18-8-7-16-11-17(21(22)24-19(16)12-18)14-29-20(25)13-23-30(26,27)10-9-15-5-3-2-4-6-15/h2-12,23H,13-14H2,1H3/b10-9+