1-[(2R,3S)-3-aminocarbonyl-2-(2-methylpropyl)hexanoyl]-4-phenylazanyl-piperidine-4-carboxamide

Systemtic Name: 1-[(2R,3S)-3-aminocarbonyl-2-(2-methylpropyl)hexanoyl]-4-phenylazanyl-piperidine-4-carboxamide Openeye Name: 4-anilino-1-[(2R,3S)-3-carbamoyl-2-isobutyl-hexanoyl]piperidine-4-carboxamide CAS Name: 4-anilino-1-[(2R,3S)-3-carbamoyl-2-(2-methylpropyl)-1-oxohexyl]-4-piperidinecarboxamide IUPAC Name: 4-anilino-1-[(2R,3S)-3-carbamoyl-2-(2-methylpropyl)hexanoyl]piperidine-4-carboxamide Traditional Name: 4-anilino-1-[(2R,3S)-3-carbamoyl-2-isobutyl-hexanoyl]isonipecotamide Formula: C23H36N4O3 MolecularWeight: 416.55694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCC(CC1)(C(=O)N)NC2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCC(CC1)(C(=O)N)NC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C23H36N4O3/c1-4-8-18(20(24)28)19(15-16(2)3)21(29)27-13-11-23(12-14-27,22(25)30)26-17-9-6-5-7-10-17/h5-7,9-10,16,18-19,26H,4,8,11-15H2,1-3H3,(H2,24,28)(H2,25,30)/t18-,19+/m0/s1