ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethyl-quinoline-3-carboxylate Openeye Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethyl-quinoline-3-carboxylate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethylquinoline-3-carboxylate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-ethyl-quinoline-3-carboxylic acid ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22N2O4/c1-3-14-6-5-7-16-20(14)23-13-17(22(25)26-4-2)21(16)24-15-8-9-18-19(12-15)28-11-10-27-18/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,23,24)