ethyl 4-[[3-(2-morpholin-4-ylethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[3-(2-morpholin-4-ylethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[3-(2-morpholinoethylcarbamoyl)-4-pyrrolidin-1-yl-phenyl]carbamoylamino]benzoate CAS Name: 4-[[[3-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-4-(1-pyrrolidinyl)anilino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2-morpholin-4-ylethylcarbamoyl)-4-pyrrolidin-1-ylphenyl]carbamoylamino]benzoate Traditional Name: 4-[[3-(2-morpholinoethylcarbamoyl)-4-pyrrolidino-phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C27H35N5O5 MolecularWeight: 509.5973

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)N3CCCC3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C27H35N5O5/c1-2-37-26(34)20-5-7-21(8-6-20)29-27(35)30-22-9-10-24(32-12-3-4-13-32)23(19-22)25(33)28-11-14-31-15-17-36-18-16-31/h5-10,19H,2-4,11-18H2,1H3,(H,28,33)(H2,29,30,35)