methyl 2-azanyl-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate Openeye Name: methyl 2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-1-(2-fluorophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carboxylic acid methyl ester Formula: C26H25FN2O5 MolecularWeight: 464.485503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3F)N)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3F)N)C(=O)OC)C4=CC5=C(C=C4)OCO5)C(=O)C1)C

InChI

InChI=1S/C26H25FN2O5/c1-26(2)11-17-22(18(30)12-26)21(14-8-9-19-20(10-14)34-13-33-19)23(25(31)32-3)24(28)29(17)16-7-5-4-6-15(16)27/h4-10,21H,11-13,28H2,1-3H3