ethyl 5-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoyl]amino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoyl]amino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoyl]amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[2-(1,3-dioxo-2-isoindolyl)-1-oxo-3-phenylpropyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(3-phenyl-2-phthalimido-propanoyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C32H25N5O5 MolecularWeight: 559.5714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C(CC4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C(CC4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C32H25N5O5/c1-2-42-32(41)24-19-33-37(27-17-16-21-12-6-9-15-25(21)34-27)28(24)35-29(38)26(18-20-10-4-3-5-11-20)36-30(39)22-13-7-8-14-23(22)31(36)40/h3-17,19,26H,2,18H2,1H3,(H,35,38)