2-methoxyethyl (3R,4S)-3-(oxidanylcarbamoyl)-4-(4-phenylpiperazin-1-yl)carbonyl-piperidine-1-carboxylate

Systemtic Name: 2-methoxyethyl (3R,4S)-3-(oxidanylcarbamoyl)-4-(4-phenylpiperazin-1-yl)carbonyl-piperidine-1-carboxylate Openeye Name: 2-methoxyethyl (3R,4S)-3-(hydroxycarbamoyl)-4-(4-phenylpiperazine-1-carbonyl)piperidine-1-carboxylate CAS Name: (3R,4S)-3-[(hydroxyamino)-oxomethyl]-4-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-piperidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (3R,4S)-3-(hydroxycarbamoyl)-4-(4-phenylpiperazine-1-carbonyl)piperidine-1-carboxylate Traditional Name: (3R,4S)-3-(hydroxycarbamoyl)-4-(4-phenylpiperazine-1-carbonyl)piperidine-1-carboxylic acid 2-methoxyethyl ester Formula: C21H30N4O6 MolecularWeight: 434.4861

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)N1CCC(C(C1)C(=O)NO)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COCCOC(=O)N1CC[C@@H]([C@H](C1)C(=O)NO)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H30N4O6/c1-30-13-14-31-21(28)25-8-7-17(18(15-25)19(26)22-29)20(27)24-11-9-23(10-12-24)16-5-3-2-4-6-16/h2-6,17-18,29H,7-15H2,1H3,(H,22,26)/t17-,18-/m0/s1