(2S)-N-cyclohexyl-2-[2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-oxidanyl-propanamide

Systemtic Name: (2S)-N-cyclohexyl-2-[2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-oxidanyl-propanamide Openeye Name: (2S)-N-cyclohexyl-3-hydroxy-2-[[2-(7-methoxy-2-oxo-chromen-4-yl)acetyl]amino]propanamide CAS Name: (2S)-N-cyclohexyl-3-hydroxy-2-[[2-(7-methoxy-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-cyclohexyl-3-hydroxy-2-[[2-(7-methoxy-2-oxochromen-4-yl)acetyl]amino]propanamide Traditional Name: (2S)-N-cyclohexyl-3-hydroxy-2-[[2-(2-keto-7-methoxy-chromen-4-yl)acetyl]amino]propionamide Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC(CO)C(=O)NC3CCCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N[C@@H](CO)C(=O)NC3CCCCC3

InChI

InChI=1S/C21H26N2O6/c1-28-15-7-8-16-13(10-20(26)29-18(16)11-15)9-19(25)23-17(12-24)21(27)22-14-5-3-2-4-6-14/h7-8,10-11,14,17,24H,2-6,9,12H2,1H3,(H,22,27)(H,23,25)/t17-/m0/s1