(2S)-N-(cyclohexylmethyl)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-oxidanyl-propanamide

Systemtic Name: (2S)-N-(cyclohexylmethyl)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-oxidanyl-propanamide Openeye Name: (2S)-N-(cyclohexylmethyl)-3-hydroxy-2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]propanamide CAS Name: (2S)-N-(cyclohexylmethyl)-3-hydroxy-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-(cyclohexylmethyl)-3-hydroxy-2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]propanamide Traditional Name: (2S)-N-(cyclohexylmethyl)-3-hydroxy-2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]propionamide Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CO)C(=O)NCC3CCCCC3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N[C@@H](CO)C(=O)NCC3CCCCC3

InChI

InChI=1S/C22H28N2O6/c1-14-9-21(27)30-19-10-16(7-8-17(14)19)29-13-20(26)24-18(12-25)22(28)23-11-15-5-3-2-4-6-15/h7-10,15,18,25H,2-6,11-13H2,1H3,(H,23,28)(H,24,26)/t18-/m0/s1