N-methyl-N-[(2S)-1-oxidanylidene-1-[[(3S)-2-oxidanylideneazocan-3-yl]amino]-3-phenyl-propan-2-yl]octanamide

Systemtic Name: N-methyl-N-[(2S)-1-oxidanylidene-1-[[(3S)-2-oxidanylideneazocan-3-yl]amino]-3-phenyl-propan-2-yl]octanamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-[[(3S)-2-oxoazocan-3-yl]amino]ethyl]-N-methyl-octanamide CAS Name: N-methyl-N-[(2S)-1-oxo-1-[[(3S)-2-oxo-3-azocanyl]amino]-3-phenylpropan-2-yl]octanamide IUPAC Name: N-methyl-N-[(2S)-1-oxo-1-[[(3S)-2-oxoazocan-3-yl]amino]-3-phenylpropan-2-yl]octanamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[(3S)-2-ketoazocan-3-yl]amino]ethyl]-N-methyl-caprylamide Formula: C25H39N3O3 MolecularWeight: 429.59546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC2CCCCCNC2=O

Isomeric SMILES

CCCCCCCC(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N[C@H]2CCCCCNC2=O

InChI

InChI=1S/C25H39N3O3/c1-3-4-5-6-12-17-23(29)28(2)22(19-20-14-9-7-10-15-20)25(31)27-21-16-11-8-13-18-26-24(21)30/h7,9-10,14-15,21-22H,3-6,8,11-13,16-19H2,1-2H3,(H,26,30)(H,27,31)/t21-,22-/m0/s1