(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-chloro-3-indolin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 4-chloro-3-indolin-1-ylsulfonyl-benzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C24H19ClN2O8S MolecularWeight: 530.93426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)Cl

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)Cl

InChI

InChI=1S/C24H19ClN2O8S/c25-20-6-5-16(11-22(20)36(31,32)26-8-7-15-3-1-2-4-21(15)26)24(28)34-13-18-10-19(27(29)30)9-17-12-33-14-35-23(17)18/h1-6,9-11H,7-8,12-14H2