N-(1,3-benzodioxol-5-yl)-2-[(2-chloranyl-4-methyl-phenyl)sulfonylamino]benzenecarboximidate

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(2-chloranyl-4-methyl-phenyl)sulfonylamino]benzenecarboximidate Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(2-chloro-4-methyl-phenyl)sulfonylamino]benzenecarboximidate CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(2-chloro-4-methylphenyl)sulfonylamino]benzenecarboximidate IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(2-chloro-4-methylphenyl)sulfonylamino]benzenecarboximidate Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(2-chloro-4-methyl-phenyl)sulfonylamino]benzenecarboximidate Formula: C21H16ClN2O5S- MolecularWeight: 443.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=NC3=CC4=C(C=C3)OCO4)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=NC3=CC4=C(C=C3)OCO4)[O-])Cl

InChI

InChI=1S/C21H17ClN2O5S/c1-13-6-9-20(16(22)10-13)30(26,27)24-17-5-3-2-4-15(17)21(25)23-14-7-8-18-19(11-14)29-12-28-18/h2-11,24H,12H2,1H3,(H,23,25)/p-1