(3R)-4-(4-methoxyphenyl)carbonyl-N3-[(3S)-2-oxidanylidenepiperidin-3-yl]-N1-propan-2-yl-piperazine-1,3-dicarboxamide

Systemtic Name: (3R)-4-(4-methoxyphenyl)carbonyl-N3-[(3S)-2-oxidanylidenepiperidin-3-yl]-N1-propan-2-yl-piperazine-1,3-dicarboxamide Openeye Name: (3R)-N1-isopropyl-4-(4-methoxybenzoyl)-N3-[(3S)-2-oxo-3-piperidyl]piperazine-1,3-dicarboxamide CAS Name: (3R)-4-[(4-methoxyphenyl)-oxomethyl]-N3-[(3S)-2-oxo-3-piperidinyl]-N1-propan-2-ylpiperazine-1,3-dicarboxamide IUPAC Name: (3R)-4-(4-methoxybenzoyl)-3-N-[(3S)-2-oxopiperidin-3-yl]-1-N-propan-2-ylpiperazine-1,3-dicarboxamide Traditional Name: (3R)-N-isopropyl-N'-[(3S)-2-keto-3-piperidyl]-4-p-anisoyl-piperazine-1,3-dicarboxamide Formula: C22H31N5O5 MolecularWeight: 445.51204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(C(C1)C(=O)NC2CCCNC2=O)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)NC(=O)N1CCN([C@H](C1)C(=O)N[C@H]2CCCNC2=O)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H31N5O5/c1-14(2)24-22(31)26-11-12-27(21(30)15-6-8-16(32-3)9-7-15)18(13-26)20(29)25-17-5-4-10-23-19(17)28/h6-9,14,17-18H,4-5,10-13H2,1-3H3,(H,23,28)(H,24,31)(H,25,29)/t17-,18+/m0/s1