N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-ethanamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-ethanamide Openeye Name: N-[(1S)-2-(azepan-1-yl)-1-(hydroxymethyl)-2-oxo-ethyl]-2-(4-methyl-2-oxo-chromen-7-yl)oxy-acetamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-hydroxy-1-oxopropan-2-yl]-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]acetamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-hydroxy-1-oxopropan-2-yl]-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide Traditional Name: N-[(1S)-2-(azepan-1-yl)-2-keto-1-methylol-ethyl]-2-(2-keto-4-methyl-chromen-7-yl)oxy-acetamide Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CO)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N[C@@H](CO)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O6/c1-14-10-20(26)29-18-11-15(6-7-16(14)18)28-13-19(25)22-17(12-24)21(27)23-8-4-2-3-5-9-23/h6-7,10-11,17,24H,2-5,8-9,12-13H2,1H3,(H,22,25)/t17-/m0/s1