methyl 6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-carbamoyl]pyridine-3-carboxylate CAS Name: 6-[[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylamino]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylcarbamoyl]pyridine-3-carboxylate Traditional Name: 6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-carbamoyl]nicotinic acid methyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=NC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=NC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21N3O6/c1-3-23(19(25)15-6-4-13(11-21-15)20(26)27-2)12-18(24)22-14-5-7-16-17(10-14)29-9-8-28-16/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,22,24)