(2S,4S)-4-(dipentylcarbamoyl)-1-(diphenylcarbamoyl)piperidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-(dipentylcarbamoyl)-1-(diphenylcarbamoyl)piperidine-2-carboxylic acid Openeye Name: (2S,4S)-4-(dipentylcarbamoyl)-1-(diphenylcarbamoyl)piperidine-2-carboxylic acid CAS Name: (2S,4S)-4-[(dipentylamino)-oxomethyl]-1-[oxo-(N-phenylanilino)methyl]-2-piperidinecarboxylic acid IUPAC Name: (2S,4S)-4-(dipentylcarbamoyl)-1-(diphenylcarbamoyl)piperidine-2-carboxylic acid Traditional Name: (2S,4S)-4-(diamylcarbamoyl)-1-(diphenylcarbamoyl)pipecolinic acid Formula: C30H41N3O4 MolecularWeight: 507.66424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C1CCN(C(C1)C(=O)O)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCN(CCCCC)C(=O)[C@H]1CCN([C@@H](C1)C(=O)O)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C30H41N3O4/c1-3-5-13-20-31(21-14-6-4-2)28(34)24-19-22-32(27(23-24)29(35)36)30(37)33(25-15-9-7-10-16-25)26-17-11-8-12-18-26/h7-12,15-18,24,27H,3-6,13-14,19-23H2,1-2H3,(H,35,36)/t24-,27-/m0/s1