(2R)-N1-cyclohexyl-N4-(3-methoxyphenyl)-N2-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-1,2,4-tricarboxamide

Systemtic Name: (2R)-N1-cyclohexyl-N4-(3-methoxyphenyl)-N2-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-1,2,4-tricarboxamide Openeye Name: (2R)-N1-cyclohexyl-N4-(3-methoxyphenyl)-N2-[(3S)-2-oxo-3-piperidyl]piperazine-1,2,4-tricarboxamide CAS Name: (2R)-N1-cyclohexyl-N4-(3-methoxyphenyl)-N2-[(3S)-2-oxo-3-piperidinyl]piperazine-1,2,4-tricarboxamide IUPAC Name: (2R)-1-N-cyclohexyl-4-N-(3-methoxyphenyl)-2-N-[(3S)-2-oxopiperidin-3-yl]piperazine-1,2,4-tricarboxamide Traditional Name: (2R)-N1-cyclohexyl-N2-[(3S)-2-keto-3-piperidyl]-N4-(3-methoxyphenyl)piperazine-1,2,4-tricarboxamide Formula: C25H36N6O5 MolecularWeight: 500.59054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCN(C(C2)C(=O)NC3CCCNC3=O)C(=O)NC4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCN([C@H](C2)C(=O)N[C@H]3CCCNC3=O)C(=O)NC4CCCCC4

InChI

InChI=1S/C25H36N6O5/c1-36-19-10-5-9-18(15-19)28-24(34)30-13-14-31(25(35)27-17-7-3-2-4-8-17)21(16-30)23(33)29-20-11-6-12-26-22(20)32/h5,9-10,15,17,20-21H,2-4,6-8,11-14,16H2,1H3,(H,26,32)(H,27,35)(H,28,34)(H,29,33)/t20-,21+/m0/s1