(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate CAS Name: 4-[(4-chlorophenyl)methoxy]-3-methoxybenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-[(4-chlorophenyl)methoxy]-3-methoxybenzoate Traditional Name: 4-(4-chlorobenzyl)oxy-3-methoxy-benzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C24H20ClNO8 MolecularWeight: 485.8705

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H20ClNO8/c1-30-22-10-16(4-7-21(22)32-11-15-2-5-19(25)6-3-15)24(27)33-13-18-9-20(26(28)29)8-17-12-31-14-34-23(17)18/h2-10H,11-14H2,1H3