ethyl 2-azanyl-1-(5-bromanylpyridin-2-yl)-4-(4-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-(5-bromanylpyridin-2-yl)-4-(4-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate Openeye Name: ethyl 2-amino-1-(5-bromo-2-pyridyl)-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate CAS Name: 2-amino-1-(5-bromo-2-pyridinyl)-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-(5-bromopyridin-2-yl)-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate Traditional Name: 2-amino-1-(5-bromo-2-pyridyl)-4-(4-chlorophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carboxylic acid ethyl ester Formula: C25H25BrClN3O3 MolecularWeight: 530.8413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)Cl)C(=O)CC(C2)(C)C)C4=NC=C(C=C4)Br)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)Cl)C(=O)CC(C2)(C)C)C4=NC=C(C=C4)Br)N

InChI

InChI=1S/C25H25BrClN3O3/c1-4-33-24(32)22-20(14-5-8-16(27)9-6-14)21-17(11-25(2,3)12-18(21)31)30(23(22)28)19-10-7-15(26)13-29-19/h5-10,13,20H,4,11-12,28H2,1-3H3