ethyl 6-chloranyl-4-[[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-[[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]amino]quinoline-3-carboxylate CAS Name: 6-chloro-4-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]amino]quinoline-3-carboxylate Traditional Name: 6-chloro-4-[[2-[cyclohexyl(methyl)amino]-2-keto-ethyl]amino]quinoline-3-carboxylic acid ethyl ester Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC(=O)N(C)C3CCCCC3)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC(=O)N(C)C3CCCCC3)Cl

InChI

InChI=1S/C21H26ClN3O3/c1-3-28-21(27)17-12-23-18-10-9-14(22)11-16(18)20(17)24-13-19(26)25(2)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,23,24)