(2S)-2-azanyl-3-phenyl-N-[(1-tridecanoylpiperidin-2-yl)methyl]propanamide

Systemtic Name: (2S)-2-azanyl-3-phenyl-N-[(1-tridecanoylpiperidin-2-yl)methyl]propanamide Openeye Name: (2S)-2-amino-3-phenyl-N-[(1-tridecanoyl-2-piperidyl)methyl]propanamide CAS Name: (2S)-2-amino-N-[[1-(1-oxotridecyl)-2-piperidinyl]methyl]-3-phenylpropanamide IUPAC Name: (2S)-2-amino-3-phenyl-N-[(1-tridecanoylpiperidin-2-yl)methyl]propanamide Traditional Name: (2S)-2-amino-3-phenyl-N-[(1-tridecanoyl-2-piperidyl)methyl]propionamide Formula: C28H47N3O2 MolecularWeight: 457.69168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)N1CCCCC1CNC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CCCCCCCCCCCCC(=O)N1CCCCC1CNC(=O)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C28H47N3O2/c1-2-3-4-5-6-7-8-9-10-14-20-27(32)31-21-16-15-19-25(31)23-30-28(33)26(29)22-24-17-12-11-13-18-24/h11-13,17-18,25-26H,2-10,14-16,19-23,29H2,1H3,(H,30,33)/t25?,26-/m0/s1