ethyl 2-[[1-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]benzoate

Systemtic Name: ethyl 2-[[1-(4-ethyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]benzoate Openeye Name: ethyl 2-[[1-(4-ethyl-3-oxo-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]benzoate CAS Name: 2-[[[[1-(4-ethyl-3-oxo-2-quinoxalinyl)-4-piperidinyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-ethyl-3-oxoquinoxalin-2-yl)piperidin-4-yl]carbamoylamino]benzoate Traditional Name: 2-[[1-(4-ethyl-3-keto-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]benzoic acid ethyl ester Formula: C25H29N5O4 MolecularWeight: 463.52886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC4=CC=CC=C4C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC4=CC=CC=C4C(=O)OCC

InChI

InChI=1S/C25H29N5O4/c1-3-30-21-12-8-7-11-20(21)27-22(23(30)31)29-15-13-17(14-16-29)26-25(33)28-19-10-6-5-9-18(19)24(32)34-4-2/h5-12,17H,3-4,13-16H2,1-2H3,(H2,26,28,33)