(2S)-4-(diphenylcarbamoyl)-1-[pentyl(phenyl)carbamoyl]piperazine-2-carboxylic acid

Systemtic Name: (2S)-4-(diphenylcarbamoyl)-1-[pentyl(phenyl)carbamoyl]piperazine-2-carboxylic acid Openeye Name: (2S)-4-(diphenylcarbamoyl)-1-[pentyl(phenyl)carbamoyl]piperazine-2-carboxylic acid CAS Name: (2S)-1-[oxo-(N-pentylanilino)methyl]-4-[oxo-(N-phenylanilino)methyl]-2-piperazinecarboxylic acid IUPAC Name: (2S)-4-(diphenylcarbamoyl)-1-[pentyl(phenyl)carbamoyl]piperazine-2-carboxylic acid Traditional Name: (2S)-1-[amyl(phenyl)carbamoyl]-4-(diphenylcarbamoyl)piperazine-2-carboxylic acid Formula: C30H34N4O4 MolecularWeight: 514.61536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=CC=CC=C1)C(=O)N2CCN(CC2C(=O)O)C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCN(C1=CC=CC=C1)C(=O)N2CCN(C[C@H]2C(=O)O)C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H34N4O4/c1-2-3-13-20-32(24-14-7-4-8-15-24)30(38)33-22-21-31(23-27(33)28(35)36)29(37)34(25-16-9-5-10-17-25)26-18-11-6-12-19-26/h4-12,14-19,27H,2-3,13,20-23H2,1H3,(H,35,36)/t27-/m0/s1