ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(7-methyl-2-piperidin-1-yl-quinolin-3-yl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(7-methyl-2-piperidin-1-yl-quinolin-3-yl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-[7-methyl-2-(1-piperidyl)-3-quinolyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-[7-methyl-2-(1-piperidinyl)-3-quinolinyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(7-methyl-2-piperidin-1-ylquinolin-3-yl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-(chloromethyl)-5-cyano-4-(7-methyl-2-piperidino-3-quinolyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C25H27ClN4O3 MolecularWeight: 466.95988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(N=C3C=C(C=CC3=C2)C)N4CCCCC4)C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(N=C3C=C(C=CC3=C2)C)N4CCCCC4)C#N)N)CCl

InChI

InChI=1S/C25H27ClN4O3/c1-3-32-25(31)22-20(13-26)33-23(28)18(14-27)21(22)17-12-16-8-7-15(2)11-19(16)29-24(17)30-9-5-4-6-10-30/h7-8,11-12,21H,3-6,9-10,13,28H2,1-2H3