methyl 2-[[1-(4-methyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[1-(4-methyl-3-oxidanylidene-quinoxalin-2-yl)piperidin-4-yl]carbamoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[1-(4-methyl-3-oxo-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]-3-phenyl-propanoate CAS Name: 2-[[[[1-(4-methyl-3-oxo-2-quinoxalinyl)-4-piperidinyl]amino]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-methyl-3-oxoquinoxalin-2-yl)piperidin-4-yl]carbamoylamino]-3-phenylpropanoate Traditional Name: 2-[[1-(3-keto-4-methyl-quinoxalin-2-yl)-4-piperidyl]carbamoylamino]-3-phenyl-propionic acid methyl ester Formula: C25H29N5O4 MolecularWeight: 463.52886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC(CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2N=C(C1=O)N3CCC(CC3)NC(=O)NC(CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H29N5O4/c1-29-21-11-7-6-10-19(21)27-22(23(29)31)30-14-12-18(13-15-30)26-25(33)28-20(24(32)34-2)16-17-8-4-3-5-9-17/h3-11,18,20H,12-16H2,1-2H3,(H2,26,28,33)