ethyl 4-azanyl-6-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]quinoline-3-carboxylate

Systemtic Name: ethyl 4-azanyl-6-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]quinoline-3-carboxylate Openeye Name: ethyl 4-amino-6-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]quinoline-3-carboxylate CAS Name: 4-amino-6-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]quinoline-3-carboxylate Traditional Name: 4-amino-6-(3-phthalimidopropanoylamino)quinoline-3-carboxylic acid ethyl ester Formula: C23H20N4O5 MolecularWeight: 432.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H20N4O5/c1-2-32-23(31)17-12-25-18-8-7-13(11-16(18)20(17)24)26-19(28)9-10-27-21(29)14-5-3-4-6-15(14)22(27)30/h3-8,11-12H,2,9-10H2,1H3,(H2,24,25)(H,26,28)