1-[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]piperidine-4-carboxamide Openeye Name: 1-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]piperidine-4-carboxamide CAS Name: 1-[(2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoyl]piperidine-4-carboxamide Traditional Name: 1-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]isonipecotamide Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)N)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C(=O)N)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H33N3O3/c1-14(2)18(21(28)25-12-10-15(11-13-25)19(23)26)24-20(27)16-6-8-17(9-7-16)22(3,4)5/h6-9,14-15,18H,10-13H2,1-5H3,(H2,23,26)(H,24,27)/t18-/m0/s1