N-methyl-N-[(2S)-1-oxidanylidene-1-[[(3S)-2-oxidanylideneazocan-3-yl]amino]-3-phenyl-propan-2-yl]dec-9-enamide

Systemtic Name: N-methyl-N-[(2S)-1-oxidanylidene-1-[[(3S)-2-oxidanylideneazocan-3-yl]amino]-3-phenyl-propan-2-yl]dec-9-enamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-[[(3S)-2-oxoazocan-3-yl]amino]ethyl]-N-methyl-dec-9-enamide CAS Name: N-methyl-N-[(2S)-1-oxo-1-[[(3S)-2-oxo-3-azocanyl]amino]-3-phenylpropan-2-yl]-9-decenamide IUPAC Name: N-methyl-N-[(2S)-1-oxo-1-[[(3S)-2-oxoazocan-3-yl]amino]-3-phenylpropan-2-yl]dec-9-enamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[(3S)-2-ketoazocan-3-yl]amino]ethyl]-N-methyl-dec-9-enamide Formula: C27H41N3O3 MolecularWeight: 455.63274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H41N3O3/c1-3-4-5-6-7-8-14-19-25(31)30(2)24(21-22-16-11-9-12-17-22)27(33)29-23-18-13-10-15-20-28-26(23)32/h3,9,11-12,16-17,23-24H,1,4-8,10,13-15,18-21H2,2H3,(H,28,32)(H,29,33)/t23-,24-/m0/s1