ethyl 6-(dimethylamino)-3-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 6-(dimethylamino)-3-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: ethyl 6-(dimethylamino)-3-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-4-oxo-1H-quinoline-2-carboxylate CAS Name: 6-(dimethylamino)-3-[(4-ethoxycarbonyl-1-piperazinyl)methyl]-4-oxo-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(dimethylamino)-3-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 3-[(4-carbethoxypiperazino)methyl]-6-(dimethylamino)-4-keto-1H-quinoline-2-carboxylic acid ethyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C22H30N4O5/c1-5-30-21(28)19-17(14-25-9-11-26(12-10-25)22(29)31-6-2)20(27)16-13-15(24(3)4)7-8-18(16)23-19/h7-8,13H,5-6,9-12,14H2,1-4H3,(H,23,27)