methyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H18N2O7/c1-20(11-12-3-4-16-17(7-12)28-6-5-27-16)18(22)13-8-14(19(23)26-2)10-15(9-13)21(24)25/h3-4,7-10H,5-6,11H2,1-2H3