ethyl 4-azanyl-6-[3-(4-chlorophenyl)propanoylamino]-2-propyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-azanyl-6-[3-(4-chlorophenyl)propanoylamino]-2-propyl-quinoline-3-carboxylate Openeye Name: ethyl 4-amino-6-[3-(4-chlorophenyl)propanoylamino]-2-propyl-quinoline-3-carboxylate CAS Name: 4-amino-6-[[3-(4-chlorophenyl)-1-oxopropyl]amino]-2-propyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-[3-(4-chlorophenyl)propanoylamino]-2-propylquinoline-3-carboxylate Traditional Name: 4-amino-6-[3-(4-chlorophenyl)propanoylamino]-2-propyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)NC(=O)CCC3=CC=C(C=C3)Cl)C(=C1C(=O)OCC)N

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)NC(=O)CCC3=CC=C(C=C3)Cl)C(=C1C(=O)OCC)N

InChI

InChI=1S/C24H26ClN3O3/c1-3-5-20-22(24(30)31-4-2)23(26)18-14-17(11-12-19(18)28-20)27-21(29)13-8-15-6-9-16(25)10-7-15/h6-7,9-12,14H,3-5,8,13H2,1-2H3,(H2,26,28)(H,27,29)