4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide

Systemtic Name: 4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Openeye Name: 4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide CAS Name: 4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)-1-oxopropyl]amino]-N-(4-cyanophenyl)-1-piperidinecarboxamide IUPAC Name: 4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Traditional Name: 4-[[(2S)-2-acetamido-3-(2,4-dimethoxyphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Formula: C26H31N5O5 MolecularWeight: 493.55484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(C=C(C=C1)OC)OC)C(=O)NC2CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)N[C@@H](CC1=C(C=C(C=C1)OC)OC)C(=O)NC2CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H31N5O5/c1-17(32)28-23(14-19-6-9-22(35-2)15-24(19)36-3)25(33)29-21-10-12-31(13-11-21)26(34)30-20-7-4-18(16-27)5-8-20/h4-9,15,21,23H,10-14H2,1-3H3,(H,28,32)(H,29,33)(H,30,34)/t23-/m0/s1